 Entering Gaussian System, Link 0=g16
 Input=17_camphor_STD_LCPBE_augccpVDZ.in
 Output=17_camphor_STD_LCPBE_augccpVDZ.log
 AtFile(1): /user/pierpa/basis_sets/augccpVDZ.gbs
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            ****
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            ****
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            ****
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            ****
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            ****
            -Mn     0
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                  1.349768D+05          -8.570592D-06
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                  6.554800D-02           5.755741D-01
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            S    20   1.00
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                  5.931155D+05          -3.282099D-06
                  1.349768D+05          -1.667433D-05
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            S    1   1.00
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            ****
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                  5.188690D+01          -2.607900D-02
                  1.934190D+01          -1.082310D-01
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            ****
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                  8.715234D+05           6.647410D-05
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                  1.921470D-01           1.433224D-02
                  8.759500D-02          -6.671210D-03
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            S    20   1.00
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                  8.715234D+05           1.552973D-06
                  1.983350D+05           8.161259D-06
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                  8.759500D-02          -5.693429D-01
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                  8.715234D+05          -4.336894D-06
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            P    16   1.00
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                  1.876862D+03           1.440000D-04
                  7.182361D+02           6.450000D-04
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            P    16   1.00
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                  1.747518D+00           3.609760D-01
                  6.995600D-01           2.716570D-01
                  2.516080D-01           1.049810D-01
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                  6.144981D+01           2.617600D-02
                  2.305689D+01           1.113670D-01
                  9.577739D+00           3.045810D-01
                  4.133734D+00           3.862990D-01
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                  6.995600D-01          -5.388760D-01
                  2.516080D-01          -3.454730D-01
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                  1.461500D+00           7.546420D-01
            F    1   1.00
                  5.486100D-01           1.000000D+00
            ****
            -Ga     0
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                  7.271900D+04           1.604700D-03
                  1.655200D+04           8.340200D-03
                  4.687800D+03           3.402480D-02
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            S    14   1.00
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            S    14   1.00
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            D    1   1.00
                  0.0537000              1.0000000
            ****
            -Ge     0
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            ****
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            ****
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                  1.060579D+03           1.274240D-02
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                  1.289984D+02           2.085635D-01
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                  2.295942D+01           3.878103D-01
                  9.507300D+00           1.003820D-01
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                  1.750446D+00           2.713900D-03
                  5.291900D-01          -6.977000D-04
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            P    11   1.00
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                  1.060579D+03          -5.221200D-03
                  3.422081D+02          -2.684630D-02
                  1.289984D+02          -9.158230D-02
                  5.308722D+01          -1.968164D-01
                  2.295942D+01          -1.634750D-01
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                  4.083055D+00           5.981592D-01
                  1.750446D+00           2.750453D-01
                  5.291900D-01           1.277060D-02
                  1.643690D-01          -1.013500D-03
            P    11   1.00
                  4.474270D+03           1.701000D-04
                  1.060579D+03           1.406400D-03
                  3.422081D+02           7.396300D-03
                  1.289984D+02           2.482540D-02
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                  2.295942D+01           4.121320D-02
                  9.507300D+00          -8.760570D-02
                  4.083055D+00          -2.440586D-01
                  1.750446D+00          -2.950070D-02
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            P    1   1.00
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            D    5   1.00
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                  3.346525D+01           1.321620D-01
                  1.183046D+01           3.633484D-01
                  4.339771D+00           4.929582D-01
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            D    1   1.00
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            ****
            -Y     0
            S    7   1.00
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                 16.6827000             -0.0497340
                 10.4235000              0.1315590
                  3.0952600             -0.5243820
                  0.7079710              0.7863790
                  0.3225670              0.4639580
                  0.0690850              0.0204860
            S    7   1.00
                 29.2935000             -0.0013580
                 16.6827000              0.0123920
                 10.4235000             -0.0375720
                  3.0952600              0.1741090
                  0.7079710             -0.3385090
                  0.3225670             -0.3354170
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            S    7   1.00
                 29.2935000              0.0112420
                 16.6827000             -0.0574010
                 10.4235000              0.1106480
                  3.0952600             -0.3769430
                  0.7079710              1.2026360
                  0.3225670             -0.4875820
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            S    1   1.00
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            P    6   1.00
                  9.0271500              0.0203960
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                  0.4727970              0.4983480
                  0.2197340              0.1957420
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            P    6   1.00
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                  0.9906740             -0.1495270
                  0.4727970             -0.2243370
                  0.2197340             -0.0114700
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            P    6   1.00
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                  4.0242700             -0.0963010
                  0.9906740              0.2986850
                  0.4727970              0.8892190
                  0.2197340             -1.4854780
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            P    1   1.00
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            D    5   1.00
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                  0.5614050              0.2962740
                  0.2267020              0.3908730
                  0.0879490              0.3539610
            D    5   1.00
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                  1.3201900             -0.1499100
                  0.5614050             -0.3732930
                  0.2267020             -0.3129870
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            D    1   1.00
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            D    1   1.00
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            F    1   1.00
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            F    1   1.00
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            ****
            -Zr     0
            S    7   1.00
                 53.4460000              0.0014860
                 17.0981000             -0.0365920
                 10.6875000              0.1321550
                  3.3913400             -0.5464540
                  0.7884750              0.8022910
                  0.3599820              0.4583040
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            S    7   1.00
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                 17.0981000              0.0096310
                 10.6875000             -0.0390430
                  3.3913400              0.1847170
                  0.7884750             -0.3584690
                  0.3599820             -0.3208280
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            S    7   1.00
                 53.4460000              0.0028110
                 17.0981000             -0.0412920
                 10.6875000              0.1148910
                  3.3913400             -0.4348090
                  0.7884750              1.4174320
                  0.3599820             -0.7286190
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            S    1   1.00
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            S    1   1.00
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            P    6   1.00
                  9.9011600              0.0214360
                  4.4181900             -0.1604130
                  1.0931000              0.4543260
                  0.5187860              0.4991190
                  0.2363630              0.1777830
                  0.0847070              0.0104040
            P    6   1.00
                  9.9011600             -0.0058310
                  4.4181900              0.0481520
                  1.0931000             -0.1600800
                  0.5187860             -0.2201350
                  0.2363630              0.0355150
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            P    6   1.00
                  9.9011600             -0.0078290
                  4.4181900              0.0660080
                  1.0931000             -0.2113740
                  0.5187860             -0.3575490
                  0.2363630              0.1703870
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            P    1   1.00
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            P    1   1.00
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            D    5   1.00
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                  1.5708900              0.1278490
                  0.6923540              0.3219090
                  0.2904140              0.3998190
                  0.1158780              0.3194760
            D    5   1.00
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                  1.5708900             -0.1579890
                  0.6923540             -0.3979000
                  0.2904140             -0.2555990
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            D    1   1.00
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            D    1   1.00
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            F    1   1.00
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            F    1   1.00
                  0.0891000              1.0000000
            ****
            -Nb     0
            S    7   1.00
                 80.8096000              0.0008890
                 17.9220000             -0.0347930
                 11.2050000              0.1389100
                  3.6990100             -0.5655680
                  0.8712090              0.8147210
                  0.3974440              0.4547970
                  0.0854690              0.0200510
            S    7   1.00
                 80.8096000             -0.0002000
                 17.9220000              0.0093020
                 11.2050000             -0.0414910
                  3.6990100              0.1923710
                  0.8712090             -0.3713520
                  0.3974440             -0.3068350
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            S    7   1.00
                 80.8096000              0.0015640
                 17.9220000             -0.0382840
                 11.2050000              0.1209450
                  3.6990100             -0.4647790
                  0.8712090              1.5031600
                  0.3974440             -0.8262330
                  0.0854690             -1.5845850
            S    1   1.00
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            S    1   1.00
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            P    6   1.00
                 10.6457000              0.0234360
                  4.8235100             -0.1683110
                  1.2030900              0.4693810
                  0.5695080              0.4980520
                  0.2569700              0.1675400
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            P    6   1.00
                 10.6457000             -0.0064960
                  4.8235100              0.0513810
                  1.2030900             -0.1706080
                  0.5695080             -0.2198720
                  0.2569700              0.0561670
                  0.0929460              0.6165950
            P    6   1.00
                 10.6457000             -0.0091300
                  4.8235100              0.0732300
                  1.2030900             -0.2370360
                  0.5695080             -0.3685640
                  0.2569700              0.2364390
                  0.0929460              0.8267330
            P    1   1.00
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            P    1   1.00
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            D    5   1.00
                  4.5456300             -0.0104650
                  1.8272300              0.1305530
                  0.8257640              0.3347580
                  0.3551560              0.4020270
                  0.1447240              0.3008350
            D    5   1.00
                  4.5456300              0.0105280
                  1.8272300             -0.1615000
                  0.8257640             -0.4113720
                  0.3551560             -0.2117820
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            D    1   1.00
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            D    1   1.00
                  0.0204000              1.0000000
            F    1   1.00
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            F    1   1.00
                  0.1387000              1.0000000
            ****
            -Mo     0
            S    7   1.00
                106.9780000              0.0007350
                 18.8824000             -0.0350900
                 11.8077000              0.1473480
                  4.0211800             -0.5833630
                  0.9568160              0.8256350
                  0.4356920              0.4523110
                  0.0925180              0.0190550
            S    7   1.00
                106.9780000             -0.0001760
                 18.8824000              0.0093320
                 11.8077000             -0.0438110
                  4.0211800              0.1972320
                  0.9568160             -0.3773110
                  0.4356920             -0.2939670
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            S    7   1.00
                106.9780000              0.0011660
                 18.8824000             -0.0376070
                 11.8077000              0.1259800
                  4.0211800             -0.4752370
                  0.9568160              1.4989830
                  0.4356920             -0.8223450
                  0.0925180             -1.5606240
            S    1   1.00
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            S    1   1.00
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            P    6   1.00
                 11.4118000              0.0253450
                  5.2453500             -0.1752130
                  1.3188400              0.4812720
                  0.6229830              0.4972610
                  0.2791080              0.1595550
                  0.1005260              0.0075430
            P    6   1.00
                 11.4118000             -0.0070220
                  5.2453500              0.0533390
                  1.3188400             -0.1756430
                  0.6229830             -0.2162130
                  0.2791080              0.0679580
                  0.1005260              0.6128160
            P    6   1.00
                 11.4118000             -0.0104200
                  5.2453500              0.0798670
                  1.3188400             -0.2629000
                  0.6229830             -0.3651840
                  0.2791080              0.2866730
                  0.1005260              0.8002580
            P    1   1.00
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            P    1   1.00
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            D    5   1.00
                  5.2576100             -0.0147610
                  2.1046200              0.1319820
                  0.9582010              0.3470860
                  0.4140470              0.4054710
                  0.1684500              0.2880580
            D    5   1.00
                  5.2576100              0.0154390
                  2.1046200             -0.1606210
                  0.9582010             -0.4232290
                  0.4140470             -0.1923390
                  0.1684500              0.5314590
            D    1   1.00
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            D    1   1.00
                  0.0231000              1.0000000
            F    1   1.00
                  0.6007000              1.0000000
            F    1   1.00
                  0.1850000              1.0000000
            ****
            -Tc     0
            S    7   1.00
                132.6560000              0.0006860
                 19.8986000             -0.0360010
                 12.4450000              0.1564650
                  4.3605000             -0.5995730
                  1.0443600              0.8357100
                  0.4741590              0.4490550
                  0.0987360              0.0183780
            S    7   1.00
                132.6560000             -0.0001680
                 19.8986000              0.0093110
                 12.4450000             -0.0455350
                  4.3605000              0.1986020
                  1.0443600             -0.3749740
                  0.4741590             -0.2817600
                  0.0987360              0.6329980
            S    7   1.00
                132.6560000              0.0009800
                 19.8986000             -0.0378410
                 12.4450000              0.1317670
                  4.3605000             -0.4834180
                  1.0443600              1.4848540
                  0.4741590             -0.8047310
                  0.0987360             -1.5511910
            S    1   1.00
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            S    1   1.00
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            P    6   1.00
                 12.1789000              0.0273140
                  5.6848400             -0.1814030
                  1.4398300              0.4908910
                  0.6789090              0.4965410
                  0.3025150              0.1532990
                  0.1073070              0.0067000
            P    6   1.00
                 12.1789000             -0.0074300
                  5.6848400              0.0541370
                  1.4398300             -0.1762270
                  0.6789090             -0.2096540
                  0.3025150              0.0734980
                  0.1073070              0.6070490
            P    6   1.00
                 12.1789000             -0.0116300
                  5.6848400              0.0854050
                  1.4398300             -0.2844050
                  0.6789090             -0.3578760
                  0.3025150              0.3260330
                  0.1073070              0.7801240
            P    1   1.00
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            P    1   1.00
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            D    5   1.00
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                  2.3642400              0.1344070
                  1.0887100              0.3547260
                  0.4740600              0.4044790
                  0.1936070              0.2788770
            D    5   1.00
                  5.7601300              0.0169910
                  2.3642400             -0.1548960
                  1.0887100             -0.4281920
                  0.4740600             -0.1789920
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            D    1   1.00
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            D    1   1.00
                  0.0264000              1.0000000
            F    1   1.00
                  0.7228000              1.0000000
            F    1   1.00
                  0.2272000              1.0000000
            ****
            -Ru     0
            S    7   1.00
                159.3720000              0.0006730
                 20.9016000             -0.0371610
                 13.0741000              0.1665170
                  4.7147400             -0.6159540
                  1.1361200              0.8428300
                  0.5154640              0.4477630
                  0.1067670              0.0184450
            S    7   1.00
                159.3720000             -0.0001690
                 20.9016000              0.0093920
                 13.0741000             -0.0477130
                  4.7147400              0.2011130
                  1.1361200             -0.3734210
                  0.5154640             -0.2738590
                  0.1067670              0.6093840
            S    7   1.00
                159.3720000              0.0008950
                 20.9016000             -0.0396350
                 13.0741000              0.1442430
                  4.7147400             -0.5192870
                  1.1361200              1.5854040
                  0.5154640             -0.9082030
                  0.1067670             -1.4720020
            S    1   1.00
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            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                 12.8738000              0.0299680
                  6.1475000             -0.1879300
                  1.5652400              0.4999900
                  0.7361940              0.4957320
                  0.3263170              0.1475150
                  0.1124070              0.0060880
            P    6   1.00
                 12.8738000             -0.0078010
                  6.1475000              0.0536560
                  1.5652400             -0.1719400
                  0.7361940             -0.1991700
                  0.3263170              0.0744110
                  0.1124070              0.5971370
            P    6   1.00
                 12.8738000             -0.0135020
                  6.1475000              0.0937330
                  1.5652400             -0.3159100
                  0.7361940             -0.3618000
                  0.3263170              0.4008770
                  0.1124070              0.7537660
            P    1   1.00
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            P    1   1.00
                  0.0137000              1.0000000
            D    5   1.00
                  6.2126500             -0.0245970
                  2.7853900              0.1273340
                  1.2685100              0.3570810
                  0.5517900              0.4082070
                  0.2247310              0.2812400
            D    5   1.00
                  6.2126500              0.0261160
                  2.7853900             -0.1459400
                  1.2685100             -0.4425210
                  0.5517900             -0.1690200
                  0.2247310              0.5052370
            D    1   1.00
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            D    1   1.00
                  0.0302000              1.0000000
            F    1   1.00
                  0.8500000              1.0000000
            F    1   1.00
                  0.2719000              1.0000000
            ****
            -Rh     0
            S    7   1.00
                184.6660000              0.0006920
                 21.9974000             -0.0383930
                 13.7616000              0.1760190
                  5.0872000             -0.6299250
                  1.2294000              0.8495440
                  0.5568140              0.4457290
                  0.1140670              0.0182040
            S    7   1.00
                184.6660000             -0.0001780
                 21.9974000              0.0094560
                 13.7616000             -0.0494720
                  5.0872000              0.2018670
                  1.2294000             -0.3698090
                  0.5568140             -0.2653310
                  0.1140670              0.5891540
            S    7   1.00
                184.6660000              0.0008370
                 21.9974000             -0.0402860
                 13.7616000              0.1506490
                  5.0872000             -0.5268510
                  1.2294000              1.5723820
                  0.5568140             -0.8876430
                  0.1140670             -1.4709450
            S    1   1.00
                  0.0414150              1.0000000
            S    1   1.00
                  0.0150000              1.0000000
            P    6   1.00
                 13.6985000              0.0318210
                  6.6247600             -0.1930280
                  1.6961300              0.5062420
                  0.7973510              0.4949020
                  0.3520340              0.1440300
                  0.1233420              0.0056080
            P    6   1.00
                 13.6985000             -0.0085830
                  6.6247600              0.0568110
                  1.6961300             -0.1801720
                  0.7973510             -0.2034110
                  0.3520340              0.0848180
                  0.1233420              0.6010570
            P    6   1.00
                 13.6985000             -0.0151640
                  6.6247600              0.1011250
                  1.6961300             -0.3456410
                  0.7973510             -0.3454850
                  0.3520340              0.4221020
                  0.1233420              0.7304790
            P    1   1.00
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            P    1   1.00
                  0.0151000              1.0000000
            D    5   1.00
                 18.7370000              0.0064810
                 11.7046000             -0.0139420
                  2.2555800              0.2506820
                  0.9494110              0.4511110
                  0.3661640              0.3839990
            D    5   1.00
                 18.7370000             -0.0075900
                 11.7046000              0.0162940
                  2.2555800             -0.3347730
                  0.9494110             -0.4463960
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            D    1   1.00
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            D    1   1.00
                  0.0420000              1.0000000
            F    1   1.00
                  0.9936000              1.0000000
            F    1   1.00
                  0.3222000              1.0000000
            ****
            -Pd     0
            S    7   1.00
                208.1230000              0.0007270
                 22.8525000             -0.0409280
                 14.2986000              0.1922850
                  5.4880100             -0.6501040
                  1.3253200              0.8565530
                  0.5989570              0.4438760
                  0.1209830              0.0178500
            S    7   1.00
                208.1230000             -0.0001890
                 22.8525000              0.0098180
                 14.2986000             -0.0528760
                  5.4880100              0.2035110
                  1.3253200             -0.3639350
                  0.5989570             -0.2582190
                  0.1209830              0.5704320
            S    7   1.00
                208.1230000              0.0008000
                 22.8525000             -0.0417810
                 14.2986000              0.1593620
                  5.4880100             -0.5231230
                  1.3253200              1.4917730
                  0.5989570             -0.7916960
                  0.1209830             -1.5172540
            S    1   1.00
                  0.0434590              1.0000000
            S    1   1.00
                  0.0156000              1.0000000
            P    6   1.00
                 14.0509000              0.0379970
                  7.1390600             -0.2040770
                  1.8300700              0.5137680
                  0.8583350              0.4942400
                  0.3772750              0.1402910
                  0.1256960              0.0051570
            P    6   1.00
                 14.0509000             -0.0093130
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                  0.4340380             -0.3195670
                  0.1050310              0.6651050
            S    7   1.00
                 29.8670000              0.0324720
                 18.7203000             -0.1723550
                 11.7533000              0.3341840
                  4.5708900             -0.5725580
                  0.9478400              1.3652610
                  0.4340380             -0.6032250
                  0.1050310             -1.7315730
            S    1   1.00
                  0.0389480              1.0000000
            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                  7.3652400              0.1796820
                  4.7544000             -0.5211000
                  2.9959500              0.1911040
                  0.9941230              0.6464550
                  0.4196000              0.4240400
                  0.1182390              0.0425600
            P    6   1.00
                  7.3652400             -0.0508780
                  4.7544000              0.1495500
                  2.9959500             -0.0507540
                  0.9941230             -0.2483790
                  0.4196000             -0.1478010
                  0.1182390              0.5415390
            P    6   1.00
                  7.3652400             -0.0697670
                  4.7544000              0.2016550
                  2.9959500             -0.0482900
                  0.9941230             -0.4247200
                  0.4196000             -0.1275720
                  0.1182390              0.9415430
            P    1   1.00
                  0.0401010              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  7.5616000              0.0178690
                  4.7408700             -0.0661360
                  1.1697500              0.2554580
                  0.4793100              0.4454920
                  0.1837040              0.4029670
            D    5   1.00
                  7.5616000             -0.0205840
                  4.7408700              0.0780240
                  1.1697500             -0.3544000
                  0.4793100             -0.5155940
                  0.1837040              0.4207610
            D    1   1.00
                  0.0644090              1.0000000
            D    1   1.00
                  0.0226000              1.0000000
            F    1   1.00
                  0.3735000              1.0000000
            F    1   1.00
                  0.1286000              1.0000000
            ****
            -W     0
            S    7   1.00
                 31.1844000              0.0268990
                 19.5385000             -0.1892380
                 12.2602000              0.4339650
                  4.7203700             -0.8043720
                  1.0095700              0.9015400
                  0.4634560              0.4101950
                  0.1137920              0.0110440
            S    7   1.00
                 31.1844000             -0.0086330
                 19.5385000              0.0609770
                 12.2602000             -0.1418640
                  4.7203700              0.2797320
                  1.0095700             -0.4285050
                  0.4634560             -0.3050150
                  0.1137920              0.6713040
            S    7   1.00
                 31.1844000              0.0314780
                 19.5385000             -0.1676990
                 12.2602000              0.3282920
                  4.7203700             -0.5865250
                  1.0095700              1.4154490
                  0.4634560             -0.6488270
                  0.1137920             -1.6892530
            S    1   1.00
                  0.0416420              1.0000000
            S    1   1.00
                  0.0152000              1.0000000
            P    6   1.00
                  7.7873800              0.1852090
                  5.0493000             -0.5283120
                  3.1860200              0.1871580
                  1.0593700              0.6560130
                  0.4491060              0.4179250
                  0.1276250              0.0409650
            P    6   1.00
                  7.7873800             -0.0535080
                  5.0493000              0.1546790
                  3.1860200             -0.0504270
                  1.0593700             -0.2604500
                  0.4491060             -0.1384050
                  0.1276250              0.5459010
            P    6   1.00
                  7.7873800             -0.0749390
                  5.0493000              0.2120220
                  3.1860200             -0.0424460
                  1.0593700             -0.4793750
                  0.4491060             -0.0766750
                  0.1276250              0.9477960
            P    1   1.00
                  0.0427440              1.0000000
            P    1   1.00
                  0.0143000              1.0000000
            D    5   1.00
                  8.3098300              0.0219490
                  5.2246300             -0.0773760
                  1.2952900              0.2632410
                  0.5397610              0.4595460
                  0.2089270              0.3922120
            D    5   1.00
                  8.3098300             -0.0263810
                  5.2246300              0.0952520
                  1.2952900             -0.3960520
                  0.5397610             -0.5079960
                  0.2089270              0.5236000
            D    1   1.00
                  0.0731130              1.0000000
            D    1   1.00
                  0.0256000              1.0000000
            F    1   1.00
                  0.4769000              1.0000000
            F    1   1.00
                  0.1768000              1.0000000
            ****
            -Re     0
            S    7   1.00
                 33.0133000              0.0221330
                 20.6658000             -0.1618310
                 12.9498000              0.3812300
                  4.7782300             -0.7875220
                  1.0858000              0.8980810
                  0.5000250              0.4224690
                  0.1210690              0.0172060
            S    7   1.00
                 33.0133000             -0.0070680
                 20.6658000              0.0530520
                 12.9498000             -0.1282310
                  4.7782300              0.2853960
                  1.0858000             -0.4487810
                  0.5000250             -0.2976680
                  0.1210690              0.6634730
            S    7   1.00
                 33.0133000              0.0274240
                 20.6658000             -0.1468310
                 12.9498000              0.2908580
                  4.7782300             -0.5801000
                  1.0858000              1.4204980
                  0.5000250             -0.6321790
                  0.1210690             -1.6875030
            S    1   1.00
                  0.0438810              1.0000000
            S    1   1.00
                  0.0159000              1.0000000
            P    6   1.00
                  8.6759800              0.1394900
                  5.6538200             -0.3569770
                  1.4063900              0.4818040
                  0.6920560              0.5117960
                  0.3163520              0.1708180
                  0.1093090              0.0097820
            P    6   1.00
                  8.6759800             -0.0412390
                  5.6538200              0.1083450
                  1.4063900             -0.1688840
                  0.6920560             -0.2386860
                  0.3163520              0.0632430
                  0.1093090              0.6102210
            P    6   1.00
                  8.6759800             -0.0651350
                  5.6538200              0.1725300
                  1.4063900             -0.2649320
                  0.6920560             -0.4743410
                  0.3163520              0.3991830
                  0.1093090              0.8030920
            P    1   1.00
                  0.0385810              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  8.6719700              0.0171910
                  5.4414200             -0.0665390
                  1.3750800              0.2711570
                  0.5838300              0.4487710
                  0.2293620              0.3778590
            D    5   1.00
                  8.6719700             -0.0203340
                  5.4414200              0.0775390
                  1.3750800             -0.3686920
                  0.5838300             -0.4745880
                  0.2293620              0.4599950
            D    1   1.00
                  0.0808850              1.0000000
            D    1   1.00
                  0.0285000              1.0000000
            F    1   1.00
                  0.5533000              1.0000000
            F    1   1.00
                  0.2126000              1.0000000
            ****
            -Os     0
            S    7   1.00
                 34.5933000              0.0194050
                 21.6442000             -0.1468750
                 13.5521000              0.3551890
                  4.8950800             -0.7883690
                  1.1634600              0.9033000
                  0.5380840              0.4302560
                  0.1306730              0.0181640
            S    7   1.00
                 34.5933000             -0.0059240
                 21.6442000              0.0475810
                 13.5521000             -0.1198590
                  4.8950800              0.2905900
                  1.1634600             -0.4633260
                  0.5380840             -0.2910580
                  0.1306730              0.6489970
            S    7   1.00
                 34.5933000              0.0286790
                 21.6442000             -0.1533520
                 13.5521000              0.3066570
                  4.8950800             -0.6590400
                  1.1634600              1.6880660
                  0.5380840             -0.9098660
                  0.1306730             -1.5178370
            S    1   1.00
                  0.0469820              1.0000000
            S    1   1.00
                  0.0169000              1.0000000
            P    6   1.00
                  9.1259400              0.1316100
                  5.8907300             -0.3487910
                  1.4397800              0.5276330
                  0.6929760              0.5000040
                  0.3084380              0.1387070
                  0.1086800              0.0055910
            P    6   1.00
                  9.1259400             -0.0379630
                  5.8907300              0.1036120
                  1.4397800             -0.1857190
                  0.6929760             -0.2213770
                  0.3084380              0.0960590
                  0.1086800              0.6029380
            P    6   1.00
                  9.1259400             -0.0676070
                  5.8907300              0.1858450
                  1.4397800             -0.3480470
                  0.6929760             -0.4511480
                  0.3084380              0.5586130
                  0.1086800              0.7068530
            P    1   1.00
                  0.0381830              1.0000000
            P    1   1.00
                  0.0134000              1.0000000
            D    5   1.00
                  9.3395000              0.0158420
                  5.8557100             -0.0635100
                  1.4647600              0.2828700
                  0.6312200              0.4507810
                  0.2506620              0.3664550
            D    5   1.00
                  9.3395000             -0.0209240
                  5.8557100              0.0807150
                  1.4647600             -0.4242800
                  0.6312200             -0.4620180
                  0.2506620              0.5555660
            D    1   1.00
                  0.0891640              1.0000000
            D    1   1.00
                  0.0317000              1.0000000
            F    1   1.00
                  0.6278000              1.0000000
            F    1   1.00
                  0.2478000              1.0000000
            ****
            -Ir     0
            S    7   1.00
                 36.0577000              0.0172890
                 22.5516000             -0.1359910
                 14.1116000              0.3386690
                  5.0447500             -0.7941690
                  1.2441700              0.9080010
                  0.5769240              0.4378070
                  0.1394660              0.0187690
            S    7   1.00
                 36.0577000             -0.0049480
                 22.5516000              0.0431240
                 14.1116000             -0.1138030
                  5.0447500              0.2953180
                  1.2441700             -0.4732180
                  0.5769240             -0.2840000
                  0.1394660              0.6351880
            S    7   1.00
                 36.0577000              0.0290550
                 22.5516000             -0.1546790
                 14.1116000              0.3116730
                  5.0447500             -0.7039290
                  1.2441700              1.8161160
                  0.5769240             -1.0291110
                  0.1394660             -1.4393180
            S    1   1.00
                  0.0497400              1.0000000
            S    1   1.00
                  0.0177000              1.0000000
            P    6   1.00
                  9.5858000              0.1256510
                  6.1408800             -0.3433060
                  1.4976000              0.5536780
                  0.7141440              0.4910420
                  0.3120660              0.1228370
                  0.1151600              0.0033780
            P    6   1.00
                  9.5858000             -0.0379390
                  6.1408800              0.1069870
                  1.4976000             -0.2083670
                  0.7141440             -0.2217720
                  0.3120660              0.1266520
                  0.1151600              0.6103680
            P    6   1.00
                  9.5858000             -0.0740030
                  6.1408800              0.2101790
                  1.4976000             -0.4612670
                  0.7141440             -0.3768670
                  0.3120660              0.6521120
                  0.1151600              0.6073860
            P    1   1.00
                  0.0412770              1.0000000
            P    1   1.00
                  0.0148000              1.0000000
            D    5   1.00
                  9.9606900              0.0154630
                  6.2430300             -0.0631200
                  1.5631700              0.2923090
                  0.6819400              0.4527480
                  0.2734460              0.3571590
            D    5   1.00
                  9.9606900             -0.0198010
                  6.2430300              0.0777020
                  1.5631700             -0.4252400
                  0.6819400             -0.4331870
                  0.2734460              0.4752470
            D    1   1.00
                  0.0980080              1.0000000
            D    1   1.00
                  0.0351000              1.0000000
            F    1   1.00
                  0.7127000              1.0000000
            F    1   1.00
                  0.2898000              1.0000000
            ****
            -Pt     0
            S    7   1.00
                 37.3750000              0.0156980
                 23.3685000             -0.1285150
                 14.6164000              0.3299960
                  5.2209620             -0.8039770
                  1.3267320              0.9127650
                  0.6163210              0.4444260
                  0.1480680              0.0192250
            S    7   1.00
                 37.3750000             -0.0041400
                 23.3685000              0.0396870
                 14.6164000             -0.1100630
                  5.2209620              0.3003960
                  1.3267320             -0.4809750
                  0.6163210             -0.2769970
                  0.1480680              0.6216130
            S    7   1.00
                 37.3750000              0.0303040
                 23.3685000             -0.1595530
                 14.6164000              0.3222870
                  5.2209620             -0.7469090
                  1.3267320              1.9183060
                  0.6163210             -1.1164460
                  0.1480680             -1.3836520
            S    1   1.00
                  0.0523910              1.0000000
            S    1   1.00
                  0.0185000              1.0000000
            P    6   1.00
                  9.9926800              0.1240460
                  6.3831700             -0.3446320
                  1.5696500              0.5711200
                  0.7427790              0.4873560
                  0.3180200              0.1119590
                  0.1141460              0.0019280
            P    6   1.00
                  9.9926800             -0.0346870
                  6.3831700              0.0999320
                  1.5696500             -0.2018840
                  0.7427790             -0.1984590
                  0.3180200              0.1230340
                  0.1141460              0.5955770
            P    6   1.00
                  9.9926800             -0.0771530
                  6.3831700              0.2234940
                  1.5696500             -0.5228040
                  0.7427790             -0.3298980
                  0.3180200              0.7297730
                  0.1141460              0.5372880
            P    1   1.00
                  0.0398630              1.0000000
            P    1   1.00
                  0.0139000              1.0000000
            D    5   1.00
                 10.4126000              0.0150800
                  6.5226600             -0.0622950
                  1.6643000              0.3006490
                  0.7342080              0.4539610
                  0.2974070              0.3490010
            D    5   1.00
                 10.4126000             -0.0198660
                  6.5226600              0.0796630
                  1.6643000             -0.4687940
                  0.7342080             -0.4051740
                  0.2974070              0.5192890
            D    1   1.00
                  0.1075990              1.0000000
            D    1   1.00
                  0.0389000              1.0000000
            F    1   1.00
                  0.8018000              1.0000000
            F    1   1.00
                  0.3357000              1.0000000
            ****
            -Au     0
            S    8   1.00
                 38.0008000              0.0200090
                 23.9725000             -0.1516790
                 15.2182000              0.3639600
                  5.5399900             -0.8213260
                  1.3855100              0.9366410
                  0.6424610              0.4235270
                  0.1564960              0.0162500
                  0.0549100             -0.0009780
            S    8   1.00
                 38.0008000             -0.0053040
                 23.9725000              0.0463180
                 15.2182000             -0.1199400
                  5.5399900              0.3040620
                  1.3855100             -0.4945010
                  0.6424610             -0.2555160
                  0.1564960              0.6091630
                  0.0549100              0.5977670
            S    8   1.00
                 38.0008000              0.0323400
                 23.9725000             -0.1717620
                 15.2182000              0.3395030
                  5.5399900             -0.7461790
                  1.3855100              1.9174980
                  0.6424610             -1.1299310
                  0.1564960             -1.3662840
                  0.0549100              1.4423910
            S    1   1.00
                  0.0549100              1.0000000
            S    1   1.00
                  0.0193000              1.0000000
            P    7   1.00
                 10.3092000              0.1282170
                  6.6276500             -0.3537900
                  1.6744700              0.5662110
                  0.8011160              0.4931710
                  0.3468790              0.1137750
                  0.1227010              0.0025340
                  0.0424280              0.0006790
            P    7   1.00
                 10.3092000             -0.0358850
                  6.6276500              0.1028900
                  1.6744700             -0.2009880
                  0.8011160             -0.2010450
                  0.3468790              0.1165490
                  0.1227010              0.5949690
                  0.0424280              0.4555200
            P    7   1.00
                 10.3092000             -0.0772420
                  6.6276500              0.2226110
                  1.6744700             -0.4953530
                  0.8011160             -0.3607470
                  0.3468790              0.7100000
                  0.1227010              0.5688390
                  0.0424280              0.0011930
            P    1   1.00
                  0.0424280              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.0027000              0.0164670
                  6.8916600             -0.0680130
                  1.8080800              0.2994920
                  0.8210510              0.4543030
                  0.3441610              0.3442240
                  0.1297430              0.1212560
            D    6   1.00
                 11.0027000             -0.0236280
                  6.8916600              0.0956720
                  1.8080800             -0.5412940
                  0.8210510             -0.3955330
                  0.3441610              0.6191650
                  0.1297430              0.4682760
            D    1   1.00
                  0.1297430              1.0000000
            D    1   1.00
                  0.0489000              1.0000000
            F    1   1.00
                  0.8919000              1.0000000
            F    1   1.00
                  0.3789000              1.0000000
            ****
            -Hg     0
            S    8   1.00
                 41.4804000              0.0100720
                 22.5328000             -0.1147810
                 14.0790000              0.3564080
                  5.7247400             -0.8484430
                  1.4794800              0.9405960
                  0.6882660              0.4353290
                  0.1641810              0.0131780
                  0.0572230             -0.0023140
            S    8   1.00
                 41.4804000              0.0020320
                 22.5328000             -0.0323140
                 14.0790000              0.1153500
                  5.7247400             -0.3177630
                  1.4794800              0.5135230
                  0.6882660              0.2500500
                  0.1641810             -0.6488410
                  0.0572230             -0.5599430
            S    8   1.00
                 41.4804000              0.0218280
                 22.5328000             -0.1555640
                 14.0790000              0.3860250
                  5.7247400             -0.8961040
                  1.4794800              2.3321950
                  0.6882660             -1.5976600
                  0.1641810             -1.0536460
                  0.0572230              1.2895360
            S    1   1.00
                  0.0572230              1.0000000
            S    1   1.00
                  0.0199000              1.0000000
            P    7   1.00
                 10.5805000              0.1286920
                  6.8053900             -0.3608420
                  1.7901600              0.5641170
                  0.8622610              0.5002740
                  0.3752770              0.1137850
                  0.1284210              0.0029390
                  0.0434470              0.0004880
            P    7   1.00
                 10.5805000             -0.0344430
                  6.8053900              0.1009290
                  1.7901600             -0.1924390
                  0.8622610             -0.1960690
                  0.3752770              0.1042040
                  0.1284210              0.5873870
                  0.0434470              0.4727830
            P    7   1.00
                 10.5805000              0.0714680
                  6.8053900             -0.2108590
                  1.7901600              0.4452040
                  0.8622610              0.3916080
                  0.3752770             -0.6670830
                  0.1284210             -0.6195740
                  0.0434470             -0.0009090
            P    1   1.00
                  0.0434470              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.5841000              0.0167290
                  7.2487900             -0.0695580
                  1.9366200              0.3034370
                  0.8987480              0.4548780
                  0.3869310              0.3368080
                  0.1504660              0.1130160
            D    6   1.00
                 11.5841000             -0.0249840
                  7.2487900              0.1041030
                  1.9366200             -0.6169860
                  0.8987480             -0.3538260
                  0.3869310              0.6872800
                  0.1504660              0.3930900
            D    1   1.00
                  0.1504660              1.0000000
            D    1   1.00
                  0.0585000              1.0000000
            F    1   1.00
                  0.9974000              1.0000000
            F    1   1.00
                  0.4377000              1.0000000
            ****
            -Tl     0
            S    8   1.00
                 36.1096000              0.0229790
                 22.5732000             -0.1728970
                 14.1144000              0.4807030
                  6.1597600             -0.9532140
                  1.5706900              0.9608670
                  0.7459610              0.4319720
                  0.1958840              0.0131990
                  0.0710030             -0.0021060
            S    8   1.00
                 36.1096000              0.0059010
                 22.5732000             -0.0544410
                 14.1144000              0.1709120
                  6.1597600             -0.3868060
                  1.5706900              0.5717530
                  0.7459610              0.2895580
                  0.1958840             -0.7163850
                  0.0710030             -0.5289600
            S    1   1.00
                  0.1958840              1.0000000
            S    1   1.00
                  0.0710030              1.0000000
            S    1   1.00
                  0.0206000              1.0000000
            P    6   1.00
                 10.3856000              0.1621170
                  7.0093900             -0.4046950
                  1.7768800              0.6949780
                  0.7479420              0.4664960
                  0.1768080              0.0280130
                  0.0515320             -0.0041730
            P    6   1.00
                 10.3856000             -0.0391990
                  7.0093900              0.1017260
                  1.7768800             -0.2199420
                  0.7479420             -0.1194500
                  0.1768080              0.4597680
                  0.0515320              0.6763890
            P    1   1.00
                  0.0515320              1.0000000
            P    1   1.00
                  0.0130000              1.0000000
            D    6   1.00
                 10.9087000              0.0217120
                  6.8364900             -0.0832690
                  1.9974900              0.3418070
                  0.9144720              0.4833160
                  0.3895180              0.3047550
                  0.1501000              0.0649830
            D    1   1.00
                  0.1501000              1.0000000
            D    1   1.00
                  0.0437000              1.0000000
            ****
            -Pb     0
            S    8   1.00
                 37.4583000              0.0248240
                 23.3170000             -0.1810620
                 14.5759000              0.5007060
                  6.4337600             -0.9797370
                  1.6671900              0.9666300
                  0.8077320              0.4364870
                  0.2270840              0.0136860
                  0.0842520             -0.0020210
            S    8   1.00
                 37.4583000              0.0067850
                 23.3170000             -0.0601870
                 14.5759000              0.1889710
                  6.4337600             -0.4248380
                  1.6671900              0.6220350
                  0.8077320              0.3160880
                  0.2270840             -0.7594740
                  0.0842520             -0.5151310
            S    1   1.00
                  0.2270840              1.0000000
            S    1   1.00
                  0.0842520              1.0000000
            S    1   1.00
                  0.0278000              1.0000000
            P    6   1.00
                 10.6186000              0.1701740
                  7.1878100             -0.4241790
                  1.8943900              0.6934430
                  0.8167090              0.4737730
                  0.2036880              0.0290470
                  0.0649730             -0.0043860
            P    6   1.00
                 10.6186000             -0.0479540
                  7.1878100              0.1245560
                  1.8943900             -0.2597760
                  0.8167090             -0.1414800
                  0.2036880              0.5317690
                  0.0649730              0.6087590
            P    1   1.00
                  0.0649730              1.0000000
            P    1   1.00
                  0.0197000              1.0000000
            D    6   1.00
                 13.7266000              0.0107870
                  6.9898300             -0.0666500
                  2.1735200              0.3342590
                  1.0281200              0.4826840
                  0.4558570              0.3004140
                  0.1822000              0.0632580
            D    1   1.00
                  0.1822000              1.0000000
            D    1   1.00
                  0.0609000              1.0000000
            ****
            -Bi     0
            S    8   1.00
                211.8210000              0.0010880
                 21.3262000             -0.1058620
                 13.3654000              0.5308080
                  6.9461000             -1.0502650
                  1.7122900              0.9958560
                  0.8391070              0.3989520
                  0.2553640              0.0117780
                  0.0967000             -0.0014700
            S    8   1.00
                211.8210000              0.0004220
                 21.3262000             -0.0385370
                 13.3654000              0.2172380
                  6.9461000             -0.4810970
                  1.7122900              0.7015950
                  0.8391070              0.2905200
                  0.2553640             -0.7997780
                  0.0967000             -0.4961310
            S    1   1.00
                  0.2553640              1.0000000
            S    1   1.00
                  0.0967000              1.0000000
            S    1   1.00
                  0.0317000              1.0000000
            P    6   1.00
                 11.0644000              0.1672490
                  7.4500000             -0.4252620
                  2.0106900              0.6925250
                  0.8883210              0.4753740
                  0.2363690              0.0298590
                  0.0792900             -0.0044930
            P    6   1.00
                 11.0644000             -0.0522010
                  7.4500000              0.1390830
                  2.0106900             -0.2935560
                  0.8883210             -0.1585740
                  0.2363690              0.5743620
                  0.0792900              0.5726780
            P    1   1.00
                  0.0792900              1.0000000
            P    1   1.00
                  0.0254000              1.0000000
            D    6   1.00
                 16.2461000              0.0078080
                  6.9836300             -0.0668310
                  2.3747600              0.3241400
                  1.1537200              0.4858310
                  0.5259740              0.3010560
                  0.2151000              0.0631960
            D    1   1.00
                  0.2151000              1.0000000
            D    1   1.00
                  0.0745000              1.0000000
            ****
            -Po     0
            S    8   1.00
                295.3900000              0.0013830
                 21.2683000             -0.1050610
                 13.3379000              0.5914250
                  7.3652100             -1.1156970
                  1.7892000              1.0191620
                  0.8849940              0.3798790
                  0.2857870              0.0107810
                  0.1093240             -0.0011440
            S    8   1.00
                295.3900000              0.0006830
                 21.2683000             -0.0385730
                 13.3379000              0.2519580
                  7.3652100             -0.5330160
                  1.7892000              0.7669010
                  0.8849940              0.2818780
                  0.2857870             -0.8394770
                  0.1093240             -0.4792720
            S    1   1.00
                  0.2857870              1.0000000
            S    1   1.00
                  0.1093240              1.0000000
            S    1   1.00
                  0.0359000              1.0000000
            P    6   1.00
                 11.5069000              0.1663640
                  7.7299100             -0.4272350
                  2.1189400              0.6969640
                  0.9553230              0.4713590
                  0.2683520              0.0299870
                  0.0884940             -0.0034870
            P    6   1.00
                 11.5069000             -0.0559100
                  7.7299100              0.1511230
                  2.1189400             -0.3261600
                  0.9553230             -0.1614090
                  0.2683520              0.6016150
                  0.0884940              0.5559720
            P    1   1.00
                  0.0884940              1.0000000
            P    1   1.00
                  0.0278000              1.0000000
            D    6   1.00
                 18.7130000              0.0066940
                  7.0570800             -0.0671040
                  2.5506200              0.3257980
                  1.2506900              0.4957630
                  0.5742560              0.2931060
                  0.2330000              0.0541620
            D    1   1.00
                  0.2330000              1.0000000
            D    1   1.00
                  0.0895000              1.0000000
            ****
            -At     0
            S    8   1.00
                304.0310000              0.0010310
                 22.4085000             -0.1018690
                 14.0490000              0.5632730
                  7.5895000             -1.1045120
                  1.8949400              1.0263640
                  0.9523580              0.3833240
                  0.3170410              0.0113590
                  0.1224900             -0.0011400
            S    8   1.00
                304.0310000              0.0004960
                 22.4085000             -0.0387430
                 14.0490000              0.2490070
                  7.5895000             -0.5516910
                  1.8949400              0.8155580
                  0.9523580              0.2868020
                  0.3170410             -0.8682780
                  0.1224900             -0.4694960
            S    1   1.00
                  0.3170410              1.0000000
            S    1   1.00
                  0.1224900              1.0000000
            S    1   1.00
                  0.0404000              1.0000000
            P    6   1.00
                 12.0093000              0.1631810
                  8.0330000             -0.4244130
                  2.2239300              0.7031340
                  1.0213300              0.4641680
                  0.3012660              0.0302600
                  0.0999030             -0.0026180
            P    6   1.00
                 12.0093000             -0.0583630
                  8.0330000              0.1606310
                  2.2239300             -0.3589420
                  1.0213300             -0.1621230
                  0.3012660              0.6248880
                  0.0999030              0.5397840
            P    1   1.00
                  0.0999030              1.0000000
            P    1   1.00
                  0.0313000              1.0000000
            D    6   1.00
                 21.3084000              0.0061410
                  7.0207600             -0.0706690
                  2.7689800              0.3190200
                  1.3731400              0.5044700
                  0.6368040              0.2924810
                  0.2593000              0.0514950
            D    1   1.00
                  0.2593000              1.0000000
            D    1   1.00
                  0.1073000              1.0000000
            ****
            -Rn     0
            S    8   1.00
                383.5850000              0.0015720
                 23.2936000             -0.0761810
                 14.6096000              0.4785080
                  7.7319900             -1.0439020
                  1.9942400              1.0190710
                  1.0240700              0.3914520
                  0.3454220              0.0127820
                  0.1350810             -0.0012970
            S    8   1.00
                383.5850000              0.0009020
                 23.2936000             -0.0265350
                 14.6096000              0.2148510
                  7.7319900             -0.5453780
                  1.9942400              0.8694020
                  1.0240700              0.2728620
                  0.3454220             -0.8929670
                  0.1350810             -0.4539150
            S    1   1.00
                  0.3454220              1.0000000
            S    1   1.00
                  0.1350810              1.0000000
            S    1   1.00
                  0.0449000              1.0000000
            P    6   1.00
                 12.4992000              0.1629940
                  8.3397600             -0.4262290
                  2.3359100              0.7107760
                  1.0901900              0.4580860
                  0.3348980              0.0292130
                  0.1125460             -0.0031070
            P    6   1.00
                 12.4992000             -0.0609340
                  8.3397600              0.1694830
                  2.3359100             -0.3880550
                  1.0901900             -0.1612760
                  0.3348980              0.6446740
                  0.1125460              0.5255260
            P    1   1.00
                  0.1125460              1.0000000
            P    1   1.00
                  0.0348000              1.0000000
            D    6   1.00
                 24.1705000              0.0058780
                  6.9459900             -0.0765200
                  3.0380900              0.3071660
                  1.5168400              0.5141680
                  0.7091570              0.2972850
                  0.2888000              0.0512000
            D    1   1.00
                  0.2888000              1.0000000
            D    1   1.00
                  0.1251000              1.0000000
            ****
            
            -Y     0
            Y-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      7.85827500           135.13497400
            2      3.38212800            15.41163200
            p-g potential
              4
            2      6.84979100            29.25143700
            2      6.71009200            58.50836300
            2      3.04215900             3.78024300
            2      2.93733000             7.67654700
            d-g potential
              4
            2      5.41631500            11.84991100
            2      5.33341600            17.77810300
            2      1.97621200             2.06238300
            2      1.96111100             3.07565000
            f-g potential
              2
            2      5.02859000            -6.92807800
            2      5.00558200            -9.15509900
            -ZR     0
            ZR-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      8.63652800           150.24299400
            2      3.71763900            18.78003600
            p-g potential
              4
            2      7.62672800            33.19279100
            2      7.45320700            66.38903900
            2      3.35838900             4.62072600
            2      3.22973800             9.26027000
            d-g potential
              4
            2      5.93808600            13.99338300
            2      5.82554400            20.99588200
            2      2.20501900             2.28516600
            2      2.20629200             3.44126000
            f-g potential
              2
            2      4.80021500            -5.23932000
            2      4.79899200            -6.98742400
            -NB     0
            NB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      9.37657800           165.15673600
            2      4.04357200            21.82395100
            p-g potential
              4
            2      8.36360900            37.24928400
            2      8.16689800            74.50738900
            2      3.69307500             5.43948600
            2      3.55104700            10.91325200
            d-g potential
              4
            2      6.68910800            15.21454900
            2      6.53719300            22.83350800
            2      2.55111800             3.00005200
            2      2.56789600             4.55373400
            f-g potential
              2
            2      5.56828500            -6.28135400
            2      5.67137200            -8.75564400
            -MO     0
            MO-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.09700000           180.07685300
            2      4.37567000            24.71592000
            p-g potential
              4
            2      9.12656400            41.22767800
            2      8.86322300            82.45267000
            2      4.04494800             6.34509200
            2      3.86665700            12.45842300
            d-g potential
              4
            2      7.53575400            19.30874400
            2      7.27897600            28.97767400
            2      2.76320500             3.18951600
            2      2.77208500             4.70016900
            f-g potential
              2
            2      6.30663300            -7.17888800
            2      6.35644800            -9.74597800
            -TC     0
            TC-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.79936900           195.09130300
            2      4.70725700            27.34041300
            p-g potential
              4
            2      9.82669900            45.06081200
            2      9.56111500            90.11729500
            2      4.37857800             7.07051700
            2      4.19090700            14.04801900
            d-g potential
              4
            2      8.33604500            21.65775500
            2      8.24453300            32.47195900
            2      3.09370700             3.78952500
            2      3.16872200             6.05343000
            f-g potential
              2
            2      7.04094000            -7.99562300
            2      7.06947300           -10.74569600
            -RU     0
            RU-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     11.50059000           209.78649300
            2      5.06857500            30.21430700
            p-g potential
              4
            2     10.53263400            48.75124400
            2     10.19201000            97.49652900
            2      4.73489200             7.86018800
            2      4.50906500            15.32975100
            d-g potential
              4
            2      8.87797700            26.96750600
            2      8.76612200            40.43230300
            2      3.17019600             3.34075800
            2      3.22885100             5.25635200
            f-g potential
              2
            2      7.82024900            -8.84752500
            2      7.83964700           -11.83551800
            -RH     0
            RH-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.19481600           225.31205400
            2      5.40513700            32.44158200
            p-g potential
              4
            2     11.28075500            52.87282600
            2     10.92724800           105.74552600
            2      5.09011700             8.61934400
            2      4.85183200            16.97345900
            d-g potential
              4
            2      9.13633700            25.10850100
            2      8.96480800            37.69573100
            2      3.64361200             4.20258400
            2      3.63600700             6.29279000
            f-g potential
              2
            2      8.61622800            -9.67356800
            2      8.62943500           -12.89984700
            -PD     0
            PD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.79882500           240.26278900
            2      5.80052800            34.72996100
            p-g potential
              4
            2     11.87469700            56.74692900
            2     11.47433500           113.44441700
            2      5.51599900             9.34563900
            2      5.24804300            18.34544700
            d-g potential
              4
            2      8.50221200            28.59555400
            2      7.98332400            43.45392100
            2      3.10762800             1.85228600
            2      2.47673400             1.40676500
            f-g potential
              2
            2      9.67957100           -10.98725500
            2      9.69134900           -14.62619000
            -AG     0
            AG-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.5677140            255.0547710
            2      6.9976620             36.9833930
            p-g potential
              4
            2     11.3164960             60.7157050
            2     10.9580630            121.4438890
            2      7.1114000             10.1718660
            2      6.7733190             20.4865640
            d-g potential
              4
            2      8.9284370             29.5049380
            2     11.1025670             44.0187360
            2      5.5432120              5.3683330
            2      3.9288350              7.4083750
            f-g potential
              2
            2     11.0129130            -12.6234030
            2     11.0198980            -16.7643270
            -CD     0
            CD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     13.3551760            270.0394480
            2      7.3083780             38.8777660
            p-g potential
              4
            2     12.6597280             64.6074700
            2     12.2896390            129.2194450
            2      6.7861760             10.6225580
            2      6.4007430             21.2650460
            d-g potential
              4
            2     11.1617220             31.6639650
            2     11.2196150             47.4892160
            2      4.5377330              5.1862000
            2      4.3357270              7.5660630
            f-g potential
              2
            2     11.4789860            -12.6327850
            2     11.4870270            -16.7601710
            -IN     0
            IN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     15.3928220            281.1223500
            2      8.0558640             61.9014700
            p-g potential
              4
            2     13.9286720             67.4621540
            2     13.3472340            134.9492500
            2      7.6141320             14.7461400
            2      7.3183650             29.6392620
            d-g potential
              4
            2     14.0347150             35.4932540
            2     14.5116160             53.1787730
            2      5.5505500              9.1772810
            2      5.0594150             12.3924100
            f-g potential
              2
            2     12.5390560            -13.7280780
            2     12.5525610            -18.2068660
            -SN     0
            SN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     17.4204140            279.9886820
            2      7.6311550             62.3778100
            p-g potential
              4
            2     16.1310240             66.1625230
            2     15.6280770            132.1743960
            2      7.3256080             16.3394170
            2      6.9425190             32.4889590
            d-g potential
              4
            2     15.5149760             36.3874410
            2     15.1881600             54.5078410
            2      5.4560240              8.6968230
            2      5.3631050             12.8402080
            f-g potential
              2
            2     12.2823480            -12.5763330
            2     12.2721500            -16.5959440
            -SB     0
            SB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.3308650            281.0715810
            2      8.5565420             61.7166040
            p-g potential
              4
            2     14.4703370             67.4573800
            2     13.8161940            134.9335030
            2      8.4249240             14.7163440
            2      8.0927280             29.5185120
            d-g potential
              4
            2     14.8863310             35.4478150
            2     15.1463190             53.1434660
            2      5.9082670              9.1792230
            2      5.5943220             13.2402530
            f-g potential
              2
            2     14.4449780            -15.3668010
            2     14.4492950            -20.2961380
            -TE     0
            TE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.8144730            281.0458430
            2      8.7935260             61.6206560
            p-g potential
              4
            2     14.8778010             67.4494640
            2     14.2697310            134.9043040
            2      8.7244350             14.6895470
            2      8.2915150             29.4150630
            d-g potential
              4
            2     15.2050080             35.4320570
            2     15.2258480             53.1356870
            2      6.0717690              9.0698020
            2      5.8047600             13.1223040
            f-g potential
              2
            2     15.2061680            -15.7454500
            2     15.2017020            -20.7424480
            -I     0
            I-ECP     4     28
            g potential
              1
            2      1.00000000             0.00000000
            s-g potential
              3
            2     40.03337600            49.98964900
            2     17.30057600           281.00655600
            2      8.85172000            61.41673900
            p-g potential
              4
            2     15.72014100            67.41623900
            2     15.20822200           134.80769600
            2      8.29418600            14.56654800
            2      7.75394900            28.96842200
            d-g potential
              4
            2     13.81775100            35.53875600
            2     13.58780500            53.33975900
            2      6.94763000             9.71646600
            2      6.96009900            14.97750000
            f-g potential
              4
            2     18.52295000           -20.17661800
            2     18.25103500           -26.08807700
            2      7.55790100            -0.22043400
            2      7.59740400            -0.22164600
            -XE     0
            XE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              3
            2     40.0051840             49.9979620
            2     17.8122140            281.0133030
            2      9.3041500             61.5382550
            p-g potential
              4
            2     15.7017720             67.4391420
            2     15.2586080            134.8747110
            2      9.2921840             14.6633000
            2      8.5590030             29.3547300
            d-g potential
              6
            2     15.1856000             35.4369080
            2     14.2845000             53.1957720
            2      7.1218890              9.0462320
            2      6.9919630             13.2236810
            2      0.6239460              0.0848530
            2      0.6472840              0.0441550
            f-g potential
              4
            2     20.8815570            -23.0892950
            2     20.7834430            -30.0744750
            2      5.2533890             -0.2882270
            2      5.3611880             -0.3869240
            -HF     0
            HF-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.24885600           478.23740400
            4     10.72912700             0.38802400
            2      1.96485600            -1.07123200
            p-h potential
              6
            2      8.68346200           101.04681800
            2      7.91692000           212.19776100
            4      9.37924300             0.13264600
            4      8.24420900             0.45310800
            2      1.59668600            -0.40791400
            2      1.71028100            -0.56181700
            d-h potential
              6
            2      5.18955700            43.11546700
            2      5.25322900            65.93473200
            4      5.93787100             0.02591200
            4      5.71290600             0.03374100
            2      1.01485600            -0.28057900
            2      0.47371200            -0.08484900
            f-h potential
              2
            2      1.91260800             4.81180100
            2      1.88074000             6.41857400
            g-h potential
              2
            2      2.72418000            -4.63658500
            2      2.70895300            -5.76728800
            -TA     0
            TA-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.31806900           454.60064900
            4     10.54026700             2.83797500
            2      2.57472600            -0.81473600
            p-h potential
              6
            2      8.74334200            96.91078300
            2      7.91622300           195.85043200
            4      9.27573600             4.81252400
            4      8.10167500             6.33851200
            2      2.07712700            -0.45917300
            2      2.75037200            -0.64458600
            d-h potential
              6
            2      5.44731400            45.96997600
            2      5.21254500            69.63897200
            4      5.88435800             0.80293300
            4      5.64957900             0.42959500
            2      1.38818000            -0.30722700
            2      1.29439800            -0.46156000
            f-h potential
              2
            2      2.16127500             5.75777300
            2      2.12593900             7.67816700
            g-h potential
              2
            2      3.14592000            -5.68406600
            2      3.12794200            -7.06231300
            -W     0
            W-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     11.06379500           419.22759900
            2      8.21764100            41.19130700
            p-h potential
              6
            2      9.33818800           107.34811000
            2      8.43044800           214.69956800
            4      9.49002000             0.02544200
            4      9.48994700             0.05189500
            2      1.88299700            -0.11718400
            2      1.90697200             0.29668900
            d-h potential
              6
            2      6.20543300            58.88127900
            2      6.12215700            98.68355600
            4      6.27455600             0.01953700
            4      6.22637500             0.02195600
            2      1.96387500            -0.08857700
            2      1.88828700            -0.20972600
            f-h potential
              2
            2      2.30795300             6.23247200
            2      2.27060900             8.31134500
            g-h potential
              2
            2      3.58349100            -6.80294400
            2      3.56251500            -8.44323200
            -RE     0
            RE-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     12.16381400           421.97030000
            2      7.10759500            50.13443900
            p-h potential
              4
            2      9.68459700            88.48191000
            2      9.47621400           176.78722000
            2      7.66806600            10.43433800
            2      5.05515600            20.45874300
            d-h potential
              4
            2      6.50988800            43.16243100
            2      6.09121600            64.76775900
            2      4.16400600             5.34030100
            2      4.40737900             8.24333200
            f-h potential
              2
            2      2.56265800             7.24454300
            2      2.52154900             9.65926600
            g-h potential
              2
            2      4.03459900            -7.97494000
            2      4.00962800            -9.88273600
            -OS     0
            OS-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.00200100           424.39037600
            2      6.96276300            57.12250300
            p-h potential
              4
            2     10.49894100            88.27900300
            2      9.99252300           176.48606400
            2      6.58824800            11.71501200
            2      5.03716700            22.91500600
            d-h potential
              4
            2      7.08344100            44.77770800
            2      6.72117900            67.15364800
            2      3.79462600             5.55038700
            2      3.74812500             8.22010400
            f-h potential
              2
            2      2.82627600             8.32833200
            2      2.78119800            11.10310200
            g-h potential
              2
            2      4.49698100            -9.18134300
            2      4.46773800           -11.36160400
            -IR     0
            IR-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.83147400           426.95814900
            2      7.04791400            65.33881300
            p-h potential
              4
            2     11.10643300            88.07544200
            2     10.45655200           176.12477000
            2      6.37961400            12.68226000
            2      5.06472600            24.63594900
            d-h potential
              4
            2      7.54875400            46.43325800
            2      7.26530800            69.63807400
            2      3.80096900             6.15024800
            2      3.71828000             9.46356000
            f-h potential
              2
            2      3.09870600             9.48361000
            2      3.04946100            12.64274200
            g-h potential
              2
            2      4.96979000           -10.41069700
            2      4.93561400           -12.86319600
            -PT     0
            PT-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     14.60450000           429.64608700
            2      7.21828700            73.15688400
            p-h potential
              4
            2     11.57716200            88.02291700
            2     10.88384300           175.99819600
            2      6.42440300            13.68227400
            2      5.22419800            27.41465100
            d-h potential
              4
            2      7.69961000            43.55785200
            2      7.55080800            65.36910800
            2      3.96116400             7.01859600
            2      3.87277700            11.39173300
            f-h potential
              2
            2      3.37986900            10.71022000
            2      3.32625500            14.27812500
            g-h potential
              2
            2      5.45202000           -11.65174900
            2      5.41258500           -14.37552500
            -AU     0
            AU-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.5232180            426.6418670
            2      6.2643840             36.8006680
            p-h potential
              4
            2     11.4138670             87.0020910
            2     10.3292150            174.0043700
            2      5.7074240              8.8706100
            2      4.8281650             17.9024380
            d-h potential
              4
            2      7.4309630             49.8836550
            2      8.3219900             74.6845490
            2      4.6096420              6.4862270
            2      3.5115070              9.5468210
            f-h potential
              2
            2      3.0846390              8.7916400
            2      3.0247430             11.6584560
            g-h potential
              2
            2      3.9784420             -5.2343370
            2      4.0114910             -6.7381420
            -HG     0
            HG-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.4130710            275.7747970
            2      6.8979130             49.2678980
            p-h potential
              4
            2     11.3103200             80.5069840
            2     10.2107730            161.0348240
            2      5.9398040              9.0834160
            2      5.0197550             18.3677730
            d-h potential
              4
            2      8.4078950             51.1372560
            2      8.2140860             76.7074590
            2      4.0126120              6.5618210
            2      3.7953980              9.8180700
            f-h potential
              2
            2      3.2731060              9.4290010
            2      3.2083210             12.4948560
            g-h potential
              2
            2      4.4852960             -6.3384140
            2      4.5132000             -8.0998630
            -TL     0
            TL-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.1678050            281.2846630
            2      8.2949090             62.4342510
            p-h potential
              4
            2      7.1514920              4.6334080
            2      5.1728650              9.3417560
            2      9.8910720             72.2992530
            2      9.0033910            144.5580370
            d-h potential
              4
            2      7.1302180             35.9430390
            2      6.9269060             53.9095930
            2      5.4175700             10.3819390
            2      5.1386810             15.5838220
            f-h potential
              4
            2      5.6263990             15.8254880
            2      5.5489520             21.1040210
            2      2.8749460              2.9151270
            2      2.8214510              3.8969030
            g-h potential
              4
            2      6.6790570             -7.4945340
            2      6.7068350             -9.5405750
            2      7.2092840             -7.7979920
            2      7.0709640             -9.2595240
            -PB     0
            PB-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.2963030            281.2854990
            2      8.6326340             62.5202170
            p-h potential
              4
            2     10.2417900             72.2768970
            2      8.9241760            144.5910830
            2      6.5813420              4.7586930
            2      6.2554030              9.9406210
            d-h potential
              4
            2      7.7543360             35.8485070
            2      7.7202810             53.7243420
            2      4.9702640             10.1152560
            2      4.5637890             14.8337310
            f-h potential
              2
            2      3.8875120             12.2098920
            2      3.8119630             16.1902910
            g-h potential
              2
            2      5.6915770             -9.0966650
            2      5.7155670            -11.5319960
            -BI     0
            BI-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.0430900            283.2642270
            2      8.2216820             62.4719590
            p-h potential
              4
            2     10.4677770             72.0014990
            2      9.1189010            144.0022770
            2      6.7547910              5.0079450
            2      6.2525920              9.9915500
            d-h potential
              4
            2      8.0814740             36.3962590
            2      7.8905950             54.5976640
            2      4.9555560              9.9842940
            2      4.7045590             14.9814850
            f-h potential
              2
            2      4.2145460             13.7133830
            2      4.1334000             18.1943080
            g-h potential
              2
            2      6.2057090            -10.2474430
            2      6.2277820            -12.9557100
            -PO     0
            PO-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.2772270            283.2447060
            2      8.3995180             62.3964610
            p-h potential
              4
            2     10.6656820             71.9917160
            2      9.2837530            143.9718710
            2      6.8727490              4.9496150
            2      6.3261500              9.7404990
            d-h potential
              4
            2      8.2148660             36.3783830
            2      8.0086960             54.5627150
            2      5.0552270              9.8894990
            2      4.7825530             14.6938770
            f-h potential
              4
            2      5.0132700             17.4282950
            2      4.9846400             23.3803530
            2      1.3267600              0.1633920
            2      1.5287580              0.3245660
            g-h potential
              2
            2      6.7715260            -11.5632940
            2      6.7779250            -14.5097880
            -AT     0
            AT-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.2008320             49.9571580
            2     13.6123060            283.2103710
            2      8.5293400             62.2810520
            p-h potential
              4
            2     10.8540650             71.9823710
            2      9.4682290            143.9035320
            2      7.0311140              4.8717590
            2      6.1438580              8.9830590
            d-h potential
              4
            2      8.3135150             36.3632370
            2      7.9989650             54.5489700
            2      5.1799660              9.7762850
            2      4.9422260             14.2647550
            f-h potential
              4
            2      5.8121630             19.8701980
            2      5.7537150             26.4164520
            2      2.5134720              0.9949700
            2      2.5362610              1.4907010
            g-h potential
              4
            2      9.8957780            -22.2232030
            2      9.7373340            -26.7154760
            2      3.0133310             -0.3730440
            2      3.0977630             -0.4859460
            -RN     0
            RN-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.1512420             49.9655510
            2     14.5212410            283.0700000
            2      8.0520380             62.0028700
            p-h potential
              4
            2     11.0099420             71.9691190
            2      9.6176250            143.8605590
            2      7.3360080              4.7147610
            2      6.4062530              9.0130650
            d-h potential
              4
            2      8.3692200             36.3683650
            2      8.1169750             54.5517610
            2      5.3536560              9.6344870
            2      5.0972120             14.3879020
            f-h potential
              4
            2      6.3485710             21.7972900
            2      6.2959490             28.9468050
            2      2.8821180              1.4473650
            2      2.9080480              2.1779640
            g-h potential
              4
            2     11.0152050            -25.2280950
            2     10.9098530            -30.5661210
            2      3.4827610             -0.5748000
            2      3.6004180             -0.7795380
            
 Initial command:
 /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe "/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/Tuned_LCPBE/17_camphor_STD/Gau-13430.inp" -scrdir="/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/Tuned_LCPBE/17_camphor_STD/"
 Entering Link 1 = /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe PID=     13433.
  
 Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2016,
            Gaussian, Inc.  All Rights Reserved.
  
 This is part of the Gaussian(R) 16 program.  It is based on
 the Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.),
 the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.),
 the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.),
 the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.),
 the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.),
 the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.),
 the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.),
 the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon
 University), and the Gaussian 82(TM) system (copyright 1983,
 Carnegie Mellon University). Gaussian is a federally registered
 trademark of Gaussian, Inc.
  
 This software contains proprietary and confidential information,
 including trade secrets, belonging to Gaussian, Inc.
  
 This software is provided under written license and may be
 used, copied, transmitted, or stored only in accord with that
 written license.
  
 The following legend is applicable only to US Government
 contracts under FAR:
  
                    RESTRICTED RIGHTS LEGEND
  
 Use, reproduction and disclosure by the US Government is
 subject to restrictions as set forth in subparagraphs (a)
 and (c) of the Commercial Computer Software - Restricted
 Rights clause in FAR 52.227-19.
  
 Gaussian, Inc.
 340 Quinnipiac St., Bldg. 40, Wallingford CT 06492
  
  
 ---------------------------------------------------------------
 Warning -- This program may not be used in any manner that
 competes with the business of Gaussian, Inc. or will provide
 assistance to any competitor of Gaussian, Inc.  The licensee
 of this program is prohibited from giving any competitor of
 Gaussian, Inc. access to this program.  By using this program,
 the user acknowledges that Gaussian, Inc. is engaged in the
 business of creating and licensing software in the field of
 computational chemistry and represents and warrants to the
 licensee that it is not a competitor of Gaussian, Inc. and that
 it will not use this program in any manner prohibited above.
 ---------------------------------------------------------------
  

 Cite this work as:
 Gaussian 16, Revision A.03,
 M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, 
 M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, 
 G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. V. Marenich, 
 J. Bloino, B. G. Janesko, R. Gomperts, B. Mennucci, H. P. Hratchian, 
 J. V. Ortiz, A. F. Izmaylov, J. L. Sonnenberg, D. Williams-Young, 
 F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, 
 T. Henderson, D. Ranasinghe, V. G. Zakrzewski, J. Gao, N. Rega, 
 G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, 
 J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, 
 T. Vreven, K. Throssell, J. A. Montgomery, Jr., J. E. Peralta, 
 F. Ogliaro, M. J. Bearpark, J. J. Heyd, E. N. Brothers, K. N. Kudin, 
 V. N. Staroverov, T. A. Keith, R. Kobayashi, J. Normand, 
 K. Raghavachari, A. P. Rendell, J. C. Burant, S. S. Iyengar, 
 J. Tomasi, M. Cossi, J. M. Millam, M. Klene, C. Adamo, R. Cammi, 
 J. W. Ochterski, R. L. Martin, K. Morokuma, O. Farkas, 
 J. B. Foresman, and D. J. Fox, Gaussian, Inc., Wallingford CT, 2016.
 
 ******************************************
 Gaussian 16:  ES64L-G16RevA.03 25-Dec-2016
                16-Jul-2021 
 ******************************************
 %NoSave
 %nproc=8
 Will use up to    8 processors via shared memory.
 %mem=42GB
 %chk=17_camphor_STD_LCPBE_augccpVDZ
 ----------------------------------------------------------------------
 #P SP LC-PBEPBE/Gen Integral=UltraFineGrid SCF=(NoSymm,MaxCyc=120,Tigh
 t) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq IOp(1/33=1,3/107=029300
 0000,3/108=0293000000,3/119=1000000000,3/120=1000000000,3/130=-1,3/131
 =-1)
 ----------------------------------------------------------------------
 1/29=2,33=1,38=1,83=21,172=1/1;
 2/12=2,40=1/2;
 3/5=7,11=2,14=-4,25=1,30=1,36=2,74=1001009,75=-5,107=293000000,108=293000000,116=-2,119=1000000000,120=1000000000,130=-1,131=-1/1,2,3;
 4/5=1,9=2/1;
 5/5=2,7=120,32=2,38=6,98=1/2;
 8/6=4,10=90,11=11/1;
 10/13=10,49=112,72=3/2;
 6/7=2,8=2,9=2,10=2,28=1/1;
 7/8=1,25=21/16;
 99/5=1/99;
 Leave Link    1 at Fri Jul 16 19:14:03 2021, MaxMem=  5637144576 cpu:               1.6 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l101.exe)
 ONIOM results not found on unit 2.
 -----------------
 ROA calculations.
 -----------------
 TstMul:  ICh=     0
 TstMul:  Mul=     1
 TstMul:  ICh=     0
 TstMul:  Mul=     1
 Structure from the checkpoint file:  "17_camphor_STD_LCPBE_augccpVDZ.chk"
 Charge =  0 Multiplicity = 1
 No Z-Matrix found in chk file; cartesian coordinates used.
  C                                                 0.909392000000     -0.256340000000      0.424222000000
  C                                                -0.288665000000     -0.500024000000     -0.551274000000
  C                                                -0.053948000000      0.598961000000     -1.631490000000
  C                                                 0.591340000000      1.776614000000     -0.850814000000
  C                                                 0.596393000000      1.259663000000      0.600580000000
  C                                                -1.441722000000      0.068745000000      0.275102000000
  C                                                -0.867880000000      1.247572000000      1.065930000000
  C                                                -0.529239000000     -1.889055000000     -1.090275000000
  O                                                -2.580268000000     -0.322725000000      0.294255000000
  C                                                 2.280642000000     -0.533766000000     -0.190909000000
  C                                                 0.806031000000     -1.067470000000      1.719398000000
  H                                                 0.609760000000      0.209736000000     -2.403647000000
  H                                                -0.986507000000      0.874939000000     -2.124235000000
  H                                                 0.019349000000      2.699916000000     -0.943059000000
  H                                                 1.598811000000      1.987373000000     -1.206735000000
  H                                                -0.984333000000      1.058438000000      2.133454000000
  H                                                -1.413116000000      2.164495000000      0.837905000000
  H                                                 1.274732000000      1.792071000000      1.266719000000
  H                                                -1.431450000000     -1.907859000000     -1.702944000000
  H                                                -0.672824000000     -2.608440000000     -0.282929000000
  H                                                 0.309210000000     -2.221656000000     -1.704806000000
  H                                                 2.441196000000     -0.030031000000     -1.141406000000
  H                                                 2.414644000000     -1.604084000000     -0.357383000000
  H                                                 3.068204000000     -0.208479000000      0.493063000000
  H                                                -0.176749000000     -1.018099000000      2.186698000000
  H                                                 1.540309000000     -0.715601000000      2.447452000000
  H                                                 1.016848000000     -2.120323000000      1.524992000000
 Recover connectivity data from disk.
 After GenITR:
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 ITRead=  0  0  0  0  0  0  0
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 MicOpt= -1 -1 -1 -1 -1 -1 -1
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 ITRead=  0  0  0  0  0  0  0
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 MicOpt= -1 -1 -1 -1 -1 -1 -1
 NAtoms=     27 NQM=       27 NQMF=       0 NMMI=      0 NMMIF=      0
                NMic=       0 NMicF=      0.
                    Isotopes and Nuclear Properties:
 (Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
  in nuclear magnetons)

  Atom         1           2           3           4           5           6           7           8           9          10
 IAtWgt=          12          12          12          12          12          12          12          12          16          12
 AtmWgt=  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  15.9949146  12.0000000
 NucSpn=           0           0           0           0           0           0           0           0           0           0
 AtZEff=   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   5.6000000   3.6000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 AtZNuc=   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   8.0000000   6.0000000

  Atom        11          12          13          14          15          16          17          18          19          20
 IAtWgt=          12           1           1           1           1           1           1           1           1           1
 AtmWgt=  12.0000000   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           0           1           1           1           1           1           1           1           1           1
 AtZEff=   3.6000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   6.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000

  Atom        21          22          23          24          25          26          27
 IAtWgt=           1           1           1           1           1           1           1
 AtmWgt=   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           1           1           1           1           1           1           1
 AtZEff=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 No MM parameters found.
 Using perturbation frequencies:    0.085645
 Leave Link  101 at Fri Jul 16 19:14:04 2021, MaxMem=  5637144576 cpu:               1.9 elap:               0.3
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l202.exe)
                          Input orientation:                          
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0        0.909392   -0.256340    0.424222
      2          6           0       -0.288665   -0.500024   -0.551274
      3          6           0       -0.053948    0.598961   -1.631490
      4          6           0        0.591340    1.776614   -0.850814
      5          6           0        0.596393    1.259663    0.600580
      6          6           0       -1.441722    0.068745    0.275102
      7          6           0       -0.867880    1.247572    1.065930
      8          6           0       -0.529239   -1.889055   -1.090275
      9          8           0       -2.580268   -0.322725    0.294255
     10          6           0        2.280642   -0.533766   -0.190909
     11          6           0        0.806031   -1.067470    1.719398
     12          1           0        0.609760    0.209736   -2.403647
     13          1           0       -0.986507    0.874939   -2.124235
     14          1           0        0.019349    2.699916   -0.943059
     15          1           0        1.598811    1.987373   -1.206735
     16          1           0       -0.984333    1.058438    2.133454
     17          1           0       -1.413116    2.164495    0.837905
     18          1           0        1.274732    1.792071    1.266719
     19          1           0       -1.431450   -1.907859   -1.702944
     20          1           0       -0.672824   -2.608440   -0.282929
     21          1           0        0.309210   -2.221656   -1.704806
     22          1           0        2.441196   -0.030031   -1.141406
     23          1           0        2.414644   -1.604084   -0.357383
     24          1           0        3.068204   -0.208479    0.493063
     25          1           0       -0.176749   -1.018099    2.186698
     26          1           0        1.540309   -0.715601    2.447452
     27          1           0        1.016848   -2.120323    1.524992
 ---------------------------------------------------------------------
                    Distance matrix (angstroms):
                    1          2          3          4          5
     1  C    0.000000
     2  C    1.564070   0.000000
     3  C    2.426008   1.558758   0.000000
     4  C    2.420697   2.459108   1.553293   0.000000
     5  C    1.557991   2.281796   2.416942   1.540717   0.000000
     6  C    2.378162   1.528377   2.417052   2.884067   2.382884
     7  C    2.415002   2.450496   2.891238   2.466397   1.536487
     8  C    2.651248   1.509240   2.590181   3.840595   3.747061
     9  O    3.492710   2.449040   3.307611   3.972091   3.562157
    10  C    1.528292   2.594675   2.967938   2.937188   2.584480
    11  C    1.531697   2.583855   3.839923   3.839387   2.590608
    12  H    2.881640   2.177662   1.090060   2.206068   3.182437
    13  H    3.371774   2.202660   1.090242   2.219058   3.174618
    14  H    3.376549   3.238516   2.212085   1.090032   2.188637
    15  H    2.858245   3.190508   2.199936   1.089081   2.191071
    16  H    2.869897   3.181277   3.905322   3.450272   2.211083
    17  H    3.380180   3.208406   3.224306   2.649541   2.216567
    18  H    2.244830   3.317078   3.404191   2.225131   1.089653
    19  H    3.568178   2.148092   2.861252   4.288723   4.410393
    20  H    2.921617   2.159862   3.533984   4.598837   4.165780
    21  H    2.958960   2.156874   2.844844   4.098178   4.185315
    22  H    2.202006   2.832188   2.619457   2.601995   2.846247
    23  H    2.166357   2.926503   3.545519   3.872600   3.524880
    24  H    2.160440   3.527635   3.861802   3.446949   2.876952
    25  H    2.205969   2.788802   4.148316   4.198435   2.881270
    26  H    2.168510   3.519088   4.572472   4.241490   2.864189
    27  H    2.167412   2.939492   4.301684   4.583844   3.529253
                    6          7          8          9         10
     6  C    0.000000
     7  C    1.531123   0.000000
     8  C    2.555359   3.821299   0.000000
     9  O    1.204119   2.448180   2.928657   0.000000
    10  C    3.799497   3.829621   3.246706   4.889618   0.000000
    11  C    2.903338   2.930600   3.217485   3.748693   2.471556
    12  H    3.377004   3.911328   2.725287   4.211706   2.870688
    13  H    2.571767   3.214044   2.986274   3.134257   4.049254
    14  H    3.246799   2.632967   4.623989   4.174364   4.016948
    15  H    3.888678   3.434658   4.423670   5.005420   2.802309
    16  H    2.154569   1.090385   4.391726   2.799513   4.312521
    17  H    2.170192   1.090883   4.574974   2.800725   4.688595
    18  H    3.366345   2.219816   4.728681   4.503229   2.923363
    19  H    2.796379   4.235684   1.090734   2.796647   4.237217
    20  H    2.840761   4.089779   1.090843   3.032487   3.610499
    21  H    3.497390   4.593263   1.091452   3.993904   3.004563
    22  H    4.134405   4.177869   3.504578   5.230860   1.087645
    23  H    4.250877   4.575230   3.047095   5.197659   1.091444
    24  H    4.523692   4.235684   4.274680   5.653124   1.092650
    25  H    2.536846   2.620505   3.409012   3.137163   3.453457
    26  H    3.771845   3.400298   4.263278   4.665808   2.746289
    27  H    3.521194   3.886599   3.046882   4.205391   2.656813
                   11         12         13         14         15
    11  C    0.000000
    12  H    4.320796   0.000000
    13  H    4.664725   1.751752   0.000000
    14  H    4.679823   2.946676   2.395300   0.000000
    15  H    4.303815   2.360257   2.960268   1.752696   0.000000
    16  H    2.810041   4.883310   4.261642   3.628603   4.323473
    17  H    4.018363   4.291942   3.258715   2.347438   3.644671
    18  H    2.932844   4.051859   4.177667   2.698757   2.502228
    19  H    4.174326   3.023530   2.849460   4.890177   4.959994
    20  H    2.927612   3.752943   3.952560   5.393841   5.209150
    21  H    3.647485   2.547622   3.382854   4.988602   4.430245
    22  H    3.454597   2.237163   3.678868   3.654763   2.187190
    23  H    2.681158   3.276392   4.564554   4.960330   3.779622
    24  H    2.712783   3.822274   4.946183   4.451598   3.141687
    25  H    1.089341   4.816372   4.777389   4.863894   4.868353
    26  H    1.092263   5.025468   5.460306   5.047241   4.545610
    27  H    1.091209   4.585750   5.128536   5.506449   4.967311
                   16         17         18         19         20
    16  H    0.000000
    17  H    1.756606   0.000000
    18  H    2.528403   2.747200   0.000000
    19  H    4.869988   4.800033   5.461850   0.000000
    20  H    4.402492   4.958347   5.055579   1.755782   0.000000
    21  H    5.211958   5.354447   5.086472   1.768720   1.770798
    22  H    4.862481   4.856886   3.237246   4.340386   4.133073
    23  H    4.984610   5.502967   3.933316   4.085982   3.247573
    24  H    4.551815   5.082534   2.795941   5.287459   4.511903
    25  H    2.228684   3.671069   3.293966   4.182734   2.978982
    26  H    3.101552   4.428128   2.784435   5.242005   3.991964
    27  H    3.805190   4.973578   3.929381   4.056954   2.522266
                   21         22         23         24         25
    21  H    0.000000
    22  H    3.109020   0.000000
    23  H    2.574839   1.758704   0.000000
    24  H    4.061472   1.759679   1.760146   0.000000
    25  H    4.102257   4.348125   3.678457   3.748814   0.000000
    26  H    4.585308   3.763178   3.069359   2.532049   1.762891
    27  H    3.307962   3.675291   2.400765   2.987990   1.754259
                   26         27
    26  H    0.000000
    27  H    1.760167   0.000000
 Stoichiometry    C10H16O
 Framework group  C1[X(C10H16O)]
 Deg. of freedom    75
 Full point group                 C1      NOp   1
 RotChk:  IX=0 Diff= 3.73D-15
 Largest Abelian subgroup         C1      NOp   1
 Largest concise Abelian subgroup C1      NOp   1
                         Standard orientation:                         
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0        0.909392   -0.256340    0.424222
      2          6           0       -0.288665   -0.500024   -0.551274
      3          6           0       -0.053948    0.598961   -1.631490
      4          6           0        0.591339    1.776614   -0.850814
      5          6           0        0.596393    1.259663    0.600580
      6          6           0       -1.441722    0.068745    0.275102
      7          6           0       -0.867880    1.247572    1.065930
      8          6           0       -0.529238   -1.889055   -1.090275
      9          8           0       -2.580268   -0.322726    0.294255
     10          6           0        2.280642   -0.533765   -0.190909
     11          6           0        0.806031   -1.067470    1.719398
     12          1           0        0.609760    0.209736   -2.403647
     13          1           0       -0.986507    0.874939   -2.124235
     14          1           0        0.019348    2.699916   -0.943059
     15          1           0        1.598810    1.987374   -1.206735
     16          1           0       -0.984333    1.058438    2.133454
     17          1           0       -1.413117    2.164495    0.837905
     18          1           0        1.274731    1.792071    1.266719
     19          1           0       -1.431449   -1.907859   -1.702944
     20          1           0       -0.672823   -2.608440   -0.282929
     21          1           0        0.309211   -2.221656   -1.704806
     22          1           0        2.441196   -0.030030   -1.141406
     23          1           0        2.414644   -1.604083   -0.357383
     24          1           0        3.068204   -0.208478    0.493063
     25          1           0       -0.176749   -1.018099    2.186698
     26          1           0        1.540309   -0.715601    2.447452
     27          1           0        1.016849   -2.120323    1.524992
 ---------------------------------------------------------------------
 Rotational constants (GHZ):           1.4525294           1.1850540           1.0991328
 Leave Link  202 at Fri Jul 16 19:14:04 2021, MaxMem=  5637144576 cpu:               0.6 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l301.exe)
 General basis read from cards:  (5D, 7F)
 Centers:      12     13     14     15     16     17     18     19     20     21
 Centers:      22     23     24     25     26     27
 S 4 1.00
     Exponent=  1.3010000000D+01 Coefficients=  1.9685000000D-02
     Exponent=  1.9620000000D+00 Coefficients=  1.3797700000D-01
     Exponent=  4.4460000000D-01 Coefficients=  4.7814800000D-01
     Exponent=  1.2200000000D-01 Coefficients=  5.0124000000D-01
 S 1 1.00
     Exponent=  1.2200000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  2.9740000000D-02 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  7.2700000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  1.4100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       1      2      3      4      5      6      7      8     10     11
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients=  6.9200000000D-04
     Exponent=  1.0000000000D+03 Coefficients=  5.3290000000D-03
     Exponent=  2.2800000000D+02 Coefficients=  2.7077000000D-02
     Exponent=  6.4710000000D+01 Coefficients=  1.0171800000D-01
     Exponent=  2.1060000000D+01 Coefficients=  2.7474000000D-01
     Exponent=  7.4950000000D+00 Coefficients=  4.4856400000D-01
     Exponent=  2.7970000000D+00 Coefficients=  2.8507400000D-01
     Exponent=  5.2150000000D-01 Coefficients=  1.5204000000D-02
     Exponent=  1.5960000000D-01 Coefficients= -3.1910000000D-03
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients= -1.4600000000D-04
     Exponent=  1.0000000000D+03 Coefficients= -1.1540000000D-03
     Exponent=  2.2800000000D+02 Coefficients= -5.7250000000D-03
     Exponent=  6.4710000000D+01 Coefficients= -2.3312000000D-02
     Exponent=  2.1060000000D+01 Coefficients= -6.3955000000D-02
     Exponent=  7.4950000000D+00 Coefficients= -1.4998100000D-01
     Exponent=  2.7970000000D+00 Coefficients= -1.2726200000D-01
     Exponent=  5.2150000000D-01 Coefficients=  5.4452900000D-01
     Exponent=  1.5960000000D-01 Coefficients=  5.8049600000D-01
 S 1 1.00
     Exponent=  1.5960000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  4.6900000000D-02 Coefficients=  1.0000000000D+00
 P 4 1.00
     Exponent=  9.4390000000D+00 Coefficients=  3.8109000000D-02
     Exponent=  2.0020000000D+00 Coefficients=  2.0948000000D-01
     Exponent=  5.4560000000D-01 Coefficients=  5.0855700000D-01
     Exponent=  1.5170000000D-01 Coefficients=  4.6884200000D-01
 P 1 1.00
     Exponent=  1.5170000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  4.0410000000D-02 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  5.5000000000D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.5100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       9
 S 9 1.00
     Exponent=  1.1720000000D+04 Coefficients=  7.1000000000D-04
     Exponent=  1.7590000000D+03 Coefficients=  5.4700000000D-03
     Exponent=  4.0080000000D+02 Coefficients=  2.7837000000D-02
     Exponent=  1.1370000000D+02 Coefficients=  1.0480000000D-01
     Exponent=  3.7030000000D+01 Coefficients=  2.8306200000D-01
     Exponent=  1.3270000000D+01 Coefficients=  4.4871900000D-01
     Exponent=  5.0250000000D+00 Coefficients=  2.7095200000D-01
     Exponent=  1.0130000000D+00 Coefficients=  1.5458000000D-02
     Exponent=  3.0230000000D-01 Coefficients= -2.5850000000D-03
 S 9 1.00
     Exponent=  1.1720000000D+04 Coefficients= -1.6000000000D-04
     Exponent=  1.7590000000D+03 Coefficients= -1.2630000000D-03
     Exponent=  4.0080000000D+02 Coefficients= -6.2670000000D-03
     Exponent=  1.1370000000D+02 Coefficients= -2.5716000000D-02
     Exponent=  3.7030000000D+01 Coefficients= -7.0924000000D-02
     Exponent=  1.3270000000D+01 Coefficients= -1.6541100000D-01
     Exponent=  5.0250000000D+00 Coefficients= -1.1695500000D-01
     Exponent=  1.0130000000D+00 Coefficients=  5.5736800000D-01
     Exponent=  3.0230000000D-01 Coefficients=  5.7275900000D-01
 S 1 1.00
     Exponent=  3.0230000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  7.8960000000D-02 Coefficients=  1.0000000000D+00
 P 4 1.00
     Exponent=  1.7700000000D+01 Coefficients=  4.3018000000D-02
     Exponent=  3.8540000000D+00 Coefficients=  2.2891300000D-01
     Exponent=  1.0460000000D+00 Coefficients=  5.0872800000D-01
     Exponent=  2.7530000000D-01 Coefficients=  4.6053100000D-01
 P 1 1.00
     Exponent=  2.7530000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  6.8560000000D-02 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.1850000000D+00 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  3.3200000000D-01 Coefficients=  1.0000000000D+00
 ****
 Ernie: Thresh=  0.10000D-02 Tol=  0.10000D-05 Strict=F.
 Ernie:  33 primitive shells out of 436 were deleted.
 There are   419 symmetry adapted cartesian basis functions of A   symmetry.
 There are   397 symmetry adapted basis functions of A   symmetry.
   397 basis functions,   709 primitive gaussians,   419 cartesian basis functions
    42 alpha electrons       42 beta electrons
       nuclear repulsion energy       688.1944666599 Hartrees.
 IExCor=11009 DFT=T Ex=LC-PBE+HF Corr=PBE ExCW=0 ScaHFX=  1.000000
 ScaDFX=  1.000000  1.000000  1.000000  1.000000 ScalE2=  1.000000  1.000000
 IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=  4
 HFx  wShort=  0.000000 wLong=  0.293000 cFull=  0.000000 cShort=  0.000000 cLong=  1.000000
 DFx  wShort=  0.000000 wLong=  0.293000 cFull=  0.000000 cShort=  0.000000 cLong=  1.000000
 NAtoms=   27 NActive=   27 NUniq=   27 SFac= 1.00D+00 NAtFMM=   60 NAOKFM=F Big=F
 Integral buffers will be    131072 words long.
 Raffenetti 2 integral format.
 Two-electron integral symmetry is turned on.
 Leave Link  301 at Fri Jul 16 19:14:07 2021, MaxMem=  5637144576 cpu:              17.5 elap:               2.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l302.exe)
 NPDir=0 NMtPBC=     1 NCelOv=     1 NCel=       1 NClECP=     1 NCelD=      1
         NCelK=      1 NCelE2=     1 NClLst=     1 CellRange=     0.0.
 One-electron integrals computed using PRISM.
 One-electron integral symmetry used in STVInt
 NBasis=   397 RedAO= T EigKep=  3.36D-06  NBF=   397
 NBsUse=   397 1.00D-06 EigRej= -1.00D+00 NBFU=   397
 Precomputing XC quadrature grid using
 IXCGrd= 4 IRadAn=           5 IRanWt=          -1 IRanGd=           0 AccXCQ= 0.00D+00.
 Generated NRdTot=       0 NPtTot=           0 NUsed=           0 NTot=          32
 NSgBfM=   419   419   419   419   419 MxSgAt=    27 MxSgA2=    27.
 Leave Link  302 at Fri Jul 16 19:14:08 2021, MaxMem=  5637144576 cpu:               6.8 elap:               0.9
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l303.exe)
 DipDrv:  MaxL=2.
 Leave Link  303 at Fri Jul 16 19:14:09 2021, MaxMem=  5637144576 cpu:               2.5 elap:               0.5
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l401.exe)
 Initial guess from the checkpoint file:  "17_camphor_STD_LCPBE_augccpVDZ.chk"
 SCF N**3 symmetry information disabled.
 B after Tr=     0.000000   -0.000000    0.000000
         Rot=    1.000000   -0.000000    0.000000    0.000000 Ang=   0.00 deg.
 Guess basis will be translated and rotated to current coordinates.
 JPrj=2 DoOrth=T DoCkMO=T.
 Leave Link  401 at Fri Jul 16 19:14:10 2021, MaxMem=  5637144576 cpu:               9.3 elap:               1.3
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l502.exe)
 Integral symmetry usage will be decided dynamically.
 Closed shell SCF:
 Using DIIS extrapolation, IDIIS=  1040.
 NGot=  5637144576 LenX=  5636786003 LenY=  5636610001
 Requested convergence on RMS density matrix=1.00D-08 within 120 cycles.
 Requested convergence on MAX density matrix=1.00D-06.
 Requested convergence on             energy=1.00D-06.
 No special actions if energy rises.
 Fock matrices will be formed incrementally for  20 cycles.

 Cycle   1  Pass 1  IDiag  1:
 FoFJK:  IHMeth= 1 ICntrl=       0 DoSepK=T KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=T BraDBF=F KetDBF=F FulRan=T
         wScrn=  0.000000 ICntrl=       500 IOpCl=  0 I1Cent=           0 NGrid=           0
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 E= -464.485685908805    
 DIIS: error= 3.18D-03 at cycle   1 NSaved=   1.
 NSaved= 1 IEnMin= 1 EnMin= -464.485685908805     IErMin= 1 ErrMin= 3.18D-03
 ErrMax= 3.18D-03  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.36D-02 BMatP= 1.36D-02
 IDIUse=3 WtCom= 9.68D-01 WtEn= 3.18D-02
 Coeff-Com:  0.100D+01
 Coeff-En:   0.100D+01
 Coeff:      0.100D+01
 Gap=     0.375 Goal=   None    Shift=    0.000
 GapD=    0.375 DampG=1.000 DampE=1.000 DampFc=1.0000 IDamp=-1.
 RMSDP=2.18D-02 MaxDP=2.40D+00              OVMax= 1.73D-02

 Cycle   2  Pass 1  IDiag  1:
 RMSU=  1.97D-02    CP:  1.32D+00
 E= -464.498184054430     Delta-E=       -0.012498145625 Rises=F Damp=F
 DIIS: error= 1.44D-03 at cycle   2 NSaved=   2.
 NSaved= 2 IEnMin= 2 EnMin= -464.498184054430     IErMin= 2 ErrMin= 1.44D-03
 ErrMax= 1.44D-03  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.55D-03 BMatP= 1.36D-02
 IDIUse=3 WtCom= 9.86D-01 WtEn= 1.44D-02
 Coeff-Com:  0.112D+00 0.888D+00
 Coeff-En:   0.000D+00 0.100D+01
 Coeff:      0.110D+00 0.890D+00
 Gap=     0.358 Goal=   None    Shift=    0.000
 RMSDP=3.32D-03 MaxDP=4.45D-01 DE=-1.25D-02 OVMax= 1.20D-02

 Cycle   3  Pass 1  IDiag  1:
 RMSU=  1.45D-03    CP:  1.37D+00  1.13D+00
 E= -464.497901702952     Delta-E=        0.000282351478 Rises=F Damp=F
 DIIS: error= 1.84D-03 at cycle   3 NSaved=   3.
 NSaved= 3 IEnMin= 2 EnMin= -464.498184054430     IErMin= 2 ErrMin= 1.44D-03
 ErrMax= 1.84D-03  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.20D-03 BMatP= 1.55D-03
 IDIUse=3 WtCom= 1.89D-01 WtEn= 8.11D-01
 Coeff-Com: -0.281D-01 0.556D+00 0.473D+00
 Coeff-En:   0.000D+00 0.547D+00 0.453D+00
 Coeff:     -0.531D-02 0.548D+00 0.457D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=7.52D-04 MaxDP=8.48D-02 DE= 2.82D-04 OVMax= 7.41D-03

 Cycle   4  Pass 1  IDiag  1:
 RMSU=  3.25D-04    CP:  1.38D+00  1.16D+00  1.03D+00
 E= -464.499501088881     Delta-E=       -0.001599385929 Rises=F Damp=F
 DIIS: error= 1.25D-04 at cycle   4 NSaved=   4.
 NSaved= 4 IEnMin= 4 EnMin= -464.499501088881     IErMin= 4 ErrMin= 1.25D-04
 ErrMax= 1.25D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.33D-05 BMatP= 1.55D-03
 IDIUse=3 WtCom= 9.99D-01 WtEn= 1.25D-03
 Coeff-Com: -0.767D-02 0.105D-01 0.614D-01 0.936D+00
 Coeff-En:   0.000D+00 0.000D+00 0.000D+00 0.100D+01
 Coeff:     -0.766D-02 0.105D-01 0.613D-01 0.936D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=3.61D-04 MaxDP=4.27D-02 DE=-1.60D-03 OVMax= 9.75D-04

 Cycle   5  Pass 1  IDiag  1:
 RMSU=  1.19D-04    CP:  1.39D+00  1.18D+00  1.15D+00  1.17D+00
 E= -464.499515689436     Delta-E=       -0.000014600555 Rises=F Damp=F
 DIIS: error= 4.41D-05 at cycle   5 NSaved=   5.
 NSaved= 5 IEnMin= 5 EnMin= -464.499515689436     IErMin= 5 ErrMin= 4.41D-05
 ErrMax= 4.41D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.71D-06 BMatP= 1.33D-05
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.369D-03-0.518D-01-0.215D-01 0.359D+00 0.715D+00
 Coeff:     -0.369D-03-0.518D-01-0.215D-01 0.359D+00 0.715D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=7.07D-05 MaxDP=5.29D-03 DE=-1.46D-05 OVMax= 3.49D-04

 Cycle   6  Pass 1  IDiag  1:
 RMSU=  3.64D-05    CP:  1.39D+00  1.18D+00  1.18D+00  1.21D+00  1.15D+00
 E= -464.499518576693     Delta-E=       -0.000002887256 Rises=F Damp=F
 DIIS: error= 1.04D-05 at cycle   6 NSaved=   6.
 NSaved= 6 IEnMin= 6 EnMin= -464.499518576693     IErMin= 6 ErrMin= 1.04D-05
 ErrMax= 1.04D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 9.78D-08 BMatP= 2.71D-06
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.635D-03-0.141D-01-0.100D-01 0.250D-01 0.174D+00 0.824D+00
 Coeff:      0.635D-03-0.141D-01-0.100D-01 0.250D-01 0.174D+00 0.824D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=2.03D-05 MaxDP=2.55D-03 DE=-2.89D-06 OVMax= 1.12D-04

 Cycle   7  Pass 1  IDiag  1:
 RMSU=  9.08D-06    CP:  1.39D+00  1.18D+00  1.19D+00  1.22D+00  1.26D+00
                    CP:  1.21D+00
 E= -464.499518705038     Delta-E=       -0.000000128345 Rises=F Damp=F
 DIIS: error= 4.30D-06 at cycle   7 NSaved=   7.
 NSaved= 7 IEnMin= 7 EnMin= -464.499518705038     IErMin= 7 ErrMin= 4.30D-06
 ErrMax= 4.30D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.55D-08 BMatP= 9.78D-08
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.238D-03-0.144D-02-0.192D-02-0.152D-01 0.117D-01 0.311D+00
 Coeff-Com:  0.696D+00
 Coeff:      0.238D-03-0.144D-02-0.192D-02-0.152D-01 0.117D-01 0.311D+00
 Coeff:      0.696D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=5.99D-06 MaxDP=8.59D-04 DE=-1.28D-07 OVMax= 3.89D-05

 Cycle   8  Pass 1  IDiag  1:
 RMSU=  2.29D-06    CP:  1.39D+00  1.18D+00  1.19D+00  1.22D+00  1.29D+00
                    CP:  1.28D+00  1.12D+00
 E= -464.499518723282     Delta-E=       -0.000000018244 Rises=F Damp=F
 DIIS: error= 8.15D-07 at cycle   8 NSaved=   8.
 NSaved= 8 IEnMin= 8 EnMin= -464.499518723282     IErMin= 8 ErrMin= 8.15D-07
 ErrMax= 8.15D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 9.89D-10 BMatP= 1.55D-08
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.314D-04 0.155D-02 0.970D-03-0.726D-02-0.235D-01-0.432D-01
 Coeff-Com:  0.148D+00 0.923D+00
 Coeff:     -0.314D-04 0.155D-02 0.970D-03-0.726D-02-0.235D-01-0.432D-01
 Coeff:      0.148D+00 0.923D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=3.14D-06 MaxDP=4.51D-04 DE=-1.82D-08 OVMax= 2.36D-05

 Cycle   9  Pass 1  IDiag  1:
 RMSU=  8.85D-07    CP:  1.39D+00  1.18D+00  1.19D+00  1.22D+00  1.30D+00
                    CP:  1.32D+00  1.26D+00  1.21D+00
 E= -464.499518725095     Delta-E=       -0.000000001814 Rises=F Damp=F
 DIIS: error= 2.39D-07 at cycle   9 NSaved=   9.
 NSaved= 9 IEnMin= 9 EnMin= -464.499518725095     IErMin= 9 ErrMin= 2.39D-07
 ErrMax= 2.39D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.95D-11 BMatP= 9.89D-10
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.189D-04 0.374D-03 0.298D-03-0.709D-03-0.494D-02-0.220D-01
 Coeff-Com: -0.207D-02 0.163D+00 0.866D+00
 Coeff:     -0.189D-04 0.374D-03 0.298D-03-0.709D-03-0.494D-02-0.220D-01
 Coeff:     -0.207D-02 0.163D+00 0.866D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=3.91D-07 MaxDP=2.18D-05 DE=-1.81D-09 OVMax= 7.97D-06

 Cycle  10  Pass 1  IDiag  1:
 RMSU=  1.63D-07    CP:  1.39D+00  1.18D+00  1.19D+00  1.22D+00  1.30D+00
                    CP:  1.32D+00  1.28D+00  1.28D+00  1.17D+00
 E= -464.499518725376     Delta-E=       -0.000000000281 Rises=F Damp=F
 DIIS: error= 1.07D-07 at cycle  10 NSaved=  10.
 NSaved=10 IEnMin=10 EnMin= -464.499518725376     IErMin=10 ErrMin= 1.07D-07
 ErrMax= 1.07D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.35D-11 BMatP= 4.95D-11
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.108D-05-0.145D-03-0.740D-04 0.960D-03 0.239D-02 0.633D-03
 Coeff-Com: -0.246D-01-0.101D+00 0.283D+00 0.839D+00
 Coeff:      0.108D-05-0.145D-03-0.740D-04 0.960D-03 0.239D-02 0.633D-03
 Coeff:     -0.246D-01-0.101D+00 0.283D+00 0.839D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=1.64D-07 MaxDP=1.91D-05 DE=-2.81D-10 OVMax= 4.96D-06

 Cycle  11  Pass 1  IDiag  1:
 RMSU=  7.54D-08    CP:  1.39D+00  1.18D+00  1.19D+00  1.22D+00  1.30D+00
                    CP:  1.32D+00  1.28D+00  1.31D+00  1.23D+00  1.07D+00
 E= -464.499518725323     Delta-E=        0.000000000053 Rises=F Damp=F
 DIIS: error= 4.33D-08 at cycle  11 NSaved=  11.
 NSaved=11 IEnMin=10 EnMin= -464.499518725376     IErMin=11 ErrMin= 4.33D-08
 ErrMax= 4.33D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.48D-12 BMatP= 1.35D-11
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.218D-05-0.611D-04-0.442D-04 0.183D-03 0.838D-03 0.290D-02
 Coeff-Com: -0.240D-02-0.284D-01-0.899D-01 0.855D-01 0.103D+01
 Coeff:      0.218D-05-0.611D-04-0.442D-04 0.183D-03 0.838D-03 0.290D-02
 Coeff:     -0.240D-02-0.284D-01-0.899D-01 0.855D-01 0.103D+01
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=4.73D-08 MaxDP=3.74D-06 DE= 5.28D-11 OVMax= 3.04D-06

 Cycle  12  Pass 1  IDiag  1:
 RMSU=  2.77D-08    CP:  1.39D+00  1.18D+00  1.19D+00  1.22D+00  1.30D+00
                    CP:  1.32D+00  1.28D+00  1.31D+00  1.24D+00  1.17D+00
                    CP:  1.28D+00
 E= -464.499518725393     Delta-E=       -0.000000000069 Rises=F Damp=F
 DIIS: error= 1.99D-08 at cycle  12 NSaved=  12.
 NSaved=12 IEnMin=12 EnMin= -464.499518725393     IErMin=12 ErrMin= 1.99D-08
 ErrMax= 1.99D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.70D-13 BMatP= 1.48D-12
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.109D-06 0.282D-04 0.130D-04-0.186D-03-0.476D-03-0.105D-03
 Coeff-Com:  0.476D-02 0.206D-01-0.607D-01-0.168D+00-0.287D-01 0.123D+01
 Coeff:     -0.109D-06 0.282D-04 0.130D-04-0.186D-03-0.476D-03-0.105D-03
 Coeff:      0.476D-02 0.206D-01-0.607D-01-0.168D+00-0.287D-01 0.123D+01
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=2.61D-08 MaxDP=1.46D-06 DE=-6.91D-11 OVMax= 1.97D-06

 Cycle  13  Pass 1  IDiag  1:
 RMSU=  1.54D-08    CP:  1.39D+00  1.18D+00  1.19D+00  1.22D+00  1.30D+00
                    CP:  1.32D+00  1.28D+00  1.30D+00  1.23D+00  1.20D+00
                    CP:  1.43D+00  1.40D+00
 E= -464.499518725321     Delta-E=        0.000000000072 Rises=F Damp=F
 DIIS: error= 7.75D-09 at cycle  13 NSaved=  13.
 NSaved=13 IEnMin=12 EnMin= -464.499518725393     IErMin=13 ErrMin= 7.75D-09
 ErrMax= 7.75D-09  0.00D+00 EMaxC= 1.00D-01 BMatC= 3.83D-14 BMatP= 2.70D-13
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.276D-06 0.152D-04 0.884D-05-0.747D-04-0.234D-03-0.387D-03
 Coeff-Com:  0.164D-02 0.912D-02-0.494D-02-0.560D-01-0.138D+00 0.331D+00
 Coeff-Com:  0.857D+00
 Coeff:     -0.276D-06 0.152D-04 0.884D-05-0.747D-04-0.234D-03-0.387D-03
 Coeff:      0.164D-02 0.912D-02-0.494D-02-0.560D-01-0.138D+00 0.331D+00
 Coeff:      0.857D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=8.17D-09 MaxDP=1.01D-06 DE= 7.19D-11 OVMax= 4.59D-07

 Cycle  14  Pass 1  IDiag  1:
 RMSU=  3.90D-09    CP:  1.39D+00  1.18D+00  1.19D+00  1.22D+00  1.30D+00
                    CP:  1.32D+00  1.28D+00  1.30D+00  1.23D+00  1.20D+00
                    CP:  1.43D+00  1.55D+00  1.17D+00
 E= -464.499518725333     Delta-E=       -0.000000000013 Rises=F Damp=F
 DIIS: error= 1.58D-09 at cycle  14 NSaved=  14.
 NSaved=14 IEnMin=12 EnMin= -464.499518725393     IErMin=14 ErrMin= 1.58D-09
 ErrMax= 1.58D-09  0.00D+00 EMaxC= 1.00D-01 BMatC= 3.93D-15 BMatP= 3.83D-14
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.659D-07-0.683D-06 0.245D-06 0.106D-04 0.182D-04-0.730D-04
 Coeff-Com: -0.310D-03-0.110D-02 0.824D-02 0.126D-01-0.236D-01-0.112D+00
 Coeff-Com:  0.167D+00 0.949D+00
 Coeff:     -0.659D-07-0.683D-06 0.245D-06 0.106D-04 0.182D-04-0.730D-04
 Coeff:     -0.310D-03-0.110D-02 0.824D-02 0.126D-01-0.236D-01-0.112D+00
 Coeff:      0.167D+00 0.949D+00
 Gap=     0.352 Goal=   None    Shift=    0.000
 RMSDP=2.89D-09 MaxDP=1.86D-07 DE=-1.27D-11 OVMax= 1.22D-07

 SCF Done:  E(RLC-PBE+HF-PBE) =  -464.499518725     A.U. after   14 cycles
            NFock= 14  Conv=0.29D-08     -V/T= 2.0052
 KE= 4.621047712445D+02 PE=-2.456863029030D+03 EE= 8.420642724000D+02
 Leave Link  502 at Fri Jul 16 19:28:16 2021, MaxMem=  5637144576 cpu:            6702.2 elap:             845.8
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l801.exe)
 DoSCS=F DFT=T ScalE2(SS,OS)=  1.000000  1.000000
 Range of M.O.s used for correlation:     1   397
 NBasis=   397 NAE=    42 NBE=    42 NFC=     0 NFV=     0
 NROrb=    397 NOA=    42 NOB=    42 NVA=   355 NVB=   355

 **** Warning!!: The largest alpha MO coefficient is  0.12006949D+03

 Leave Link  801 at Fri Jul 16 19:28:17 2021, MaxMem=  5637144576 cpu:               0.7 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1002.exe)
 Minotr:  Closed shell wavefunction.
          Direct CPHF calculation.
          Differentiating once with respect to electric field.
                with respect to dipole field.
                with respect to quadrupole field.
          Differentiating once with respect to magnetic field using GIAOs.
          Electric field/nuclear overlap derivatives assumed to be zero.
          Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
          Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
          NewPWx=F KeepS1=T KeepF1=T KeepIn=T MapXYZ=F SortEE=F KeepMc=T.
         8355 words used for storage of precomputed grid.
 Two-electron integral symmetry used by symmetrizing perturbed Fock matrices.
          MDV=    5637144576 using IRadAn=       1.
          Solving linear equations simultaneously, MaxMat=     384.
          Doing perturbations at frequencies    0.085645
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=T FulRan=T
         wScrn=  0.000000 ICntrl=      6100 IOpCl=  0 I1Cent=           7 NGrid=          27
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 FoFJK:  IHMeth= 1 ICntrl=    6127 DoSepK=T KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 CalDSu exits because no D1Ps are significant.
          There are    12 degrees of freedom in the 1st order CPHF.  IDoFFX=0 NUNeed=    12.
     11 vectors produced by pass  0 Test12= 2.49D-13 8.33D-09 XBig12= 1.00D+00 1.21D-01.
 AX will form    11 AO Fock derivatives at one time.
     11 vectors produced by pass  1 Test12= 2.49D-13 8.33D-09 XBig12= 1.63D-01 4.74D-02.
     11 vectors produced by pass  2 Test12= 2.49D-13 8.33D-09 XBig12= 3.78D-02 2.42D-02.
     11 vectors produced by pass  3 Test12= 2.49D-13 8.33D-09 XBig12= 4.82D-03 1.03D-02.
     11 vectors produced by pass  4 Test12= 2.49D-13 8.33D-09 XBig12= 7.42D-04 4.48D-03.
     11 vectors produced by pass  5 Test12= 2.49D-13 8.33D-09 XBig12= 6.51D-05 1.51D-03.
     11 vectors produced by pass  6 Test12= 2.49D-13 8.33D-09 XBig12= 2.48D-06 2.49D-04.
     11 vectors produced by pass  7 Test12= 2.49D-13 8.33D-09 XBig12= 7.55D-08 3.34D-05.
     11 vectors produced by pass  8 Test12= 2.49D-13 8.33D-09 XBig12= 2.13D-09 7.29D-06.
     11 vectors produced by pass  9 Test12= 2.49D-13 8.33D-09 XBig12= 5.69D-11 1.16D-06.
      8 vectors produced by pass 10 Test12= 2.49D-13 8.33D-09 XBig12= 1.51D-12 1.32D-07.
      1 vectors produced by pass 11 Test12= 2.49D-13 8.33D-09 XBig12= 5.01D-14 1.87D-08.
 InvSVY:  IOpt=1 It=  1 EMax= 1.78D-14
 Solved reduced A of dimension   119 with    12 vectors.
 FullF1:  Do perturbations      1 to      12.
 SCF Polarizability for W=    0.085645:
                1             2             3 
      1  0.121488D+03
      2  0.100203D+01  0.116779D+03
      3 -0.265460D+00  0.153747D+01  0.112986D+03
 Isotropic polarizability for W=    0.085645      117.08 Bohr**3.
 Dipole-quadrupole polarizability for W=    0.085645:
                 1             2             3 
      1   0.259452D+02 -0.134841D+02  0.116965D+02
      2  -0.164690D+02  0.623103D+01 -0.862977D+01
      3  -0.947621D+01  0.725312D+01 -0.306671D+01
      4  -0.181576D+02  0.336086D+02 -0.178955D+02
      5   0.868594D+01 -0.180472D+02  0.434177D+02
      6  -0.109234D+02 -0.142850D+02 -0.512680D+01
 Dipole-magnetic dipole polarizability for W=    0.085645:
                 1             2             3 
      1   0.353889D-01 -0.440360D+01  0.230893D+01
      2   0.211409D+01 -0.464285D+01  0.212555D+02
      3   0.470252D+01 -0.171946D+02  0.524943D+01
 DQ contribution to OR G for W=    0.085645:
                 1             2             3 
      1  -0.151678D+00 -0.565523D+01  0.123799D+02
      2   0.301055D+01 -0.697209D+01  0.528939D+02
      3  -0.467343D+01 -0.500777D+02  0.712376D+01
 Optical Rotation G' tensor for W=    0.085645:
                 1             2             3 
      1   0.265375D+00  0.241793D+00 -0.789550D+00
      2   0.241793D+00  0.899391D+00 -0.663190D+00
      3  -0.789550D+00 -0.663190D+00 -0.522788D+00
 OR G Eigenvalues:    -1.1143     0.3250     1.4313  Iso=    -0.2140
 Eigenvectors:
   (1)   0.452848   0.229373   0.861578
   (2)   0.762908  -0.599784  -0.241309
   (3)   0.461411   0.766581  -0.446602
 w=    0.085645 a.u., Optical Rotation Beta=     -0.2140 au.
 Molar Mass =    152.2358 grams/mole, [Alpha] ( 5320.0 A) =      -66.67 deg.
 PxScal for PaGxPb-FJK:  IOpCl= 0 ISclPx=1 IMOff=     1 NMtTot=    25 NTT=   79003 ScalPx= 1.90D+02
 PxSclF for G(T1ab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   79003 IRwP= 19996     0 IPTmp= 19977     0 ScalPx= 7.73D+03
 FullF1:  Do perturbations      1 to      30.
          There are    36 degrees of freedom in the 2nd order CPHF.
     30 vectors produced by pass  0 Test12= 4.14D-14 2.78D-09 XBig12= 1.00D+00 2.92D-01.
     30 vectors produced by pass  1 Test12= 4.14D-14 2.78D-09 XBig12= 1.83D-02 2.03D-02.
     30 vectors produced by pass  2 Test12= 4.14D-14 2.78D-09 XBig12= 1.63D-03 8.42D-03.
     30 vectors produced by pass  3 Test12= 4.14D-14 2.78D-09 XBig12= 3.61D-05 1.39D-03.
     30 vectors produced by pass  4 Test12= 4.14D-14 2.78D-09 XBig12= 6.57D-07 1.13D-04.
     30 vectors produced by pass  5 Test12= 4.14D-14 2.78D-09 XBig12= 8.72D-09 1.10D-05.
     30 vectors produced by pass  6 Test12= 4.14D-14 2.78D-09 XBig12= 9.84D-11 8.90D-07.
     30 vectors produced by pass  7 Test12= 4.14D-14 2.78D-09 XBig12= 9.70D-13 7.18D-08.
     17 vectors produced by pass  8 Test12= 4.14D-14 2.78D-09 XBig12= 1.28D-14 7.21D-09.
      4 vectors produced by pass  9 Test12= 4.14D-14 2.78D-09 XBig12= 2.43D-15 4.75D-09.
      1 vectors produced by pass 10 Test12= 4.14D-14 2.78D-09 XBig12= 9.05D-16 3.35D-09.
 InvSVY:  IOpt=1 It=  1 EMax= 2.66D-15
 Solved reduced A of dimension   262 with    30 vectors.
 PxScal for FxTab-FJK:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   79003 ScalPx= 4.58D+03
 PxScal for FxTab-XC:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   79003 ScalPx= 4.58D+03
 PxSclF for G(Xab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   79003 IRwP= 19978     0 IPTmp= 19973     0 ScalPx= 5.36D+03
 FullF1:  Do perturbations      1 to      30.
 End of Minotr F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.121488D+03  0.100203D+01 -0.265460D+00
      2   0.100203D+01  0.116779D+03  0.153747D+01
      3  -0.265460D+00  0.153747D+01  0.112986D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1   0.353889D-01 -0.440360D+01  0.230893D+01
      2   0.211409D+01 -0.464285D+01  0.212555D+02
      3   0.470252D+01 -0.171946D+02  0.524943D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1   0.259452D+02 -0.134841D+02  0.116965D+02
      2  -0.164690D+02  0.623103D+01 -0.862977D+01
      3  -0.947621D+01  0.725312D+01 -0.306671D+01
      4  -0.181576D+02  0.336086D+02 -0.178955D+02
      5   0.868594D+01 -0.180472D+02  0.434177D+02
      6  -0.109234D+02 -0.142850D+02 -0.512680D+01
 End of Minotr F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    81 ND12= 1 LenFil=    2919:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.180770D+01  0.138670D+01  0.527430D+01  0.887092D+00  0.242699D+01
      2   0.138670D+01  0.272765D+01  0.330989D+00  0.242699D+01 -0.551383D+01
      3   0.527430D+01  0.330989D+00  0.273494D+01  0.241662D-01 -0.137066D+01
                 6             7             8             9            10 
      1   0.241662D-01  0.628433D+01  0.543059D+00  0.200773D+01 -0.408498D+01
      2  -0.137066D+01  0.543059D+00 -0.136212D+01  0.370742D+01 -0.192719D+01
      3   0.288449D+01  0.200773D+01  0.370742D+01 -0.807982D+00 -0.397765D+01
                11            12            13            14            15 
      1  -0.192719D+01 -0.397765D+01 -0.240438D+01  0.649672D+00  0.196174D+01
      2   0.897519D+00  0.201736D+01  0.649672D+00  0.341565D+00  0.262577D+01
      3   0.201736D+01 -0.627516D+00  0.196174D+01  0.262577D+01 -0.357589D+01
                16            17            18            19            20 
      1  -0.391003D+01  0.195175D+01 -0.187998D+01  0.221608D+01 -0.331608D+00
      2   0.195175D+01  0.206046D+01 -0.262728D+01 -0.331608D+00 -0.121825D+01
      3  -0.187998D+01 -0.262728D+01 -0.174760D+01  0.404211D+01 -0.249649D+01
                21            22            23            24            25 
      1   0.404211D+01  0.559608D+00 -0.208704D+00 -0.347295D+01  0.271339D+01
      2  -0.249649D+01 -0.208704D+00  0.574004D+00 -0.214665D+01 -0.222048D+01
      3  -0.649860D+00 -0.347295D+01 -0.214665D+01  0.214333D+01 -0.208394D+00
                26            27            28            29            30 
      1  -0.222048D+01 -0.208394D+00 -0.368190D+01 -0.237563D+01  0.225023D+01
      2  -0.282560D+01  0.148324D+01 -0.237563D+01  0.364326D+01  0.873220D+00
      3   0.148324D+01  0.237826D+01  0.225023D+01  0.873220D+00 -0.264801D+00
                31            32            33            34            35 
      1  -0.946316D+00  0.287687D+01  0.887783D+00  0.184530D+01  0.937942D+00
      2   0.287687D+01 -0.342058D+01  0.179032D+01  0.937942D+00  0.145500D+01
      3   0.887783D+00  0.179032D+01  0.168262D+01 -0.764112D-01  0.143692D+01
                36            37            38            39            40 
      1  -0.764112D-01  0.735269D+00 -0.106743D+01 -0.378273D+01  0.132318D+00
      2   0.143692D+01 -0.106743D+01 -0.302486D+01 -0.146541D+01 -0.400419D+01
      3  -0.246652D+01 -0.378273D+01 -0.146541D+01 -0.166323D+01 -0.172866D+01
                41            42            43            44            45 
      1  -0.400419D+01 -0.172866D+01 -0.308769D+01 -0.150231D+01 -0.176746D+01
      2   0.450540D+01 -0.146258D+01 -0.150231D+01 -0.305674D+00 -0.328367D+01
      3  -0.146258D+01 -0.243217D+01 -0.176746D+01 -0.328367D+01  0.166639D+01
                46            47            48            49            50 
      1   0.746509D+01  0.300187D+01  0.134812D+00  0.283210D+01 -0.104707D+01
      2   0.300187D+01 -0.335833D+01 -0.279408D+01 -0.104707D+01 -0.635106D+00
      3   0.134812D+00 -0.279408D+01 -0.187634D+01 -0.173674D+01 -0.796583D+00
                51            52            53            54            55 
      1  -0.173674D+01  0.264403D+00 -0.126576D+01  0.150096D+00 -0.110759D+01
      2  -0.796583D+00 -0.126576D+01 -0.442871D+00  0.480985D+00 -0.985151D+00
      3   0.203670D+00  0.150096D+00  0.480985D+00  0.171970D+01  0.120701D+01
                56            57            58            59            60 
      1  -0.985151D+00  0.120701D+01 -0.148093D+01  0.345888D+01  0.941362D+00
      2   0.457479D+01  0.131445D+01  0.345888D+01 -0.290134D+01  0.130598D+01
      3   0.131445D+01  0.141788D+01  0.941362D+00  0.130598D+01  0.185569D+01
                61            62            63            64            65 
      1   0.258164D+00 -0.436330D+00  0.111607D+01  0.149314D+01  0.193307D+01
      2  -0.436330D+00  0.164751D+01  0.636737D+00  0.193307D+01 -0.222829D+00
      3   0.111607D+01  0.636737D+00 -0.532414D+01  0.459794D+01 -0.120324D+01
                66            67            68            69            70 
      1   0.459794D+01  0.142426D+01 -0.682510D+00 -0.123935D+01  0.387054D+01
      2  -0.120324D+01 -0.682510D+00 -0.394425D-01 -0.272653D+01 -0.138437D+01
      3   0.969351D+00 -0.123935D+01 -0.272653D+01  0.250862D+01  0.844460D+00
                71            72            73            74            75 
      1  -0.138437D+01  0.844460D+00 -0.159708D+02 -0.301136D+01  0.104505D+01
      2  -0.274136D+01  0.293496D+01 -0.301136D+01 -0.112834D+01  0.809520D+00
      3   0.293496D+01  0.770290D+00  0.104505D+01  0.809520D+00 -0.938323D+00
                76            77            78            79            80 
      1  -0.326335D+01 -0.336973D+01  0.579340D+00  0.343761D+00  0.243581D+00
      2  -0.336973D+01 -0.205211D+01  0.585965D+00  0.243581D+00  0.135560D+00
      3   0.579340D+00  0.585965D+00 -0.386101D+00 -0.297214D+01 -0.846725D+00
                81            82            83            84            85 
      1  -0.297214D+01 -0.112613D+01 -0.167412D+01 -0.410371D+01 -0.208117D+01
      2  -0.846725D+00 -0.167412D+01 -0.146357D+01 -0.286515D+00 -0.215380D+01
      3  -0.265457D-02 -0.410371D+01 -0.286515D+00 -0.192094D+01 -0.413515D+00
                86            87            88            89            90 
      1  -0.215380D+01 -0.413515D+00 -0.478796D+01 -0.425562D+00 -0.229018D+01
      2   0.529991D+01  0.169294D+01 -0.425562D+00  0.164021D+01 -0.262607D+01
      3   0.169294D+01 -0.270093D+01 -0.229018D+01 -0.262607D+01  0.225387D+01
                91            92            93            94            95 
      1   0.171258D+01 -0.549560D+00 -0.466541D+01 -0.796546D+00 -0.175982D+01
      2  -0.549560D+00 -0.156819D+01 -0.609765D+00 -0.175982D+01  0.536763D+01
      3  -0.466541D+01 -0.609765D+00 -0.187079D+01 -0.859191D+00  0.108956D+01
                96            97            98            99           100 
      1  -0.859191D+00 -0.436663D+01 -0.780952D+00 -0.177495D+01  0.220775D+01
      2   0.108956D+01 -0.780952D+00  0.178137D+01 -0.262813D+01 -0.332444D+00
      3  -0.308676D+01 -0.177495D+01 -0.262813D+01 -0.572860D+00 -0.222306D+01
               101           102           103           104           105 
      1  -0.332444D+00 -0.222306D+01 -0.948497D+00  0.633901D+00  0.121181D+01
      2   0.117034D+01  0.634474D+00  0.633901D+00 -0.110745D+01 -0.952069D+00
      3   0.634474D+00  0.326963D+01  0.121181D+01 -0.952069D+00 -0.246827D+01
               106           107           108           109           110 
      1  -0.178756D+01  0.445750D+00  0.200426D+01 -0.440109D+01  0.975552D+00
      2   0.445750D+00 -0.903728D+00 -0.969969D+00  0.975552D+00 -0.143620D+01
      3   0.200426D+01 -0.969969D+00 -0.632875D+01 -0.338005D+01  0.125391D+01
               111           112           113           114           115 
      1  -0.338005D+01  0.836028D+00 -0.908925D+00  0.826445D+00 -0.201278D+01
      2   0.125391D+01 -0.908925D+00  0.987918D+00 -0.899719D+00  0.728536D+00
      3  -0.376260D+01  0.826445D+00 -0.899719D+00  0.844684D+00 -0.200494D+01
               116           117           118           119           120 
      1   0.728536D+00 -0.200494D+01 -0.957227D+00  0.197268D+01 -0.611074D+00
      2  -0.643023D+00  0.685758D+00  0.197268D+01 -0.379278D+01  0.709852D+00
      3   0.685758D+00 -0.378795D+01 -0.611074D+00  0.709852D+00 -0.896556D+00
               121           122           123           124           125 
      1   0.149992D+01 -0.180356D+01  0.238158D+00 -0.324920D+00  0.416313D-01
      2  -0.180356D+01  0.880848D+01 -0.169080D+01  0.416313D-01 -0.807716D+00
      3   0.238158D+00 -0.169080D+01  0.132043D+01 -0.399598D+00  0.104652D+01
               126           127           128           129           130 
      1  -0.399598D+00  0.636885D+01  0.273227D+01 -0.210906D+01  0.146152D+01
      2   0.104652D+01  0.273227D+01  0.250861D+01 -0.122039D+01  0.136065D+01
      3  -0.388119D+00 -0.210906D+01 -0.122039D+01  0.199838D+01 -0.652495D+00
               131           132           133           134           135 
      1   0.136065D+01 -0.652495D+00 -0.181131D+01 -0.867857D+00  0.147060D+01
      2   0.196394D+01 -0.831225D+00 -0.867857D+00 -0.108325D+01  0.735013D+00
      3  -0.831225D+00  0.401791D+00  0.147060D+01  0.735013D+00 -0.133838D+01
               136           137           138           139           140 
      1  -0.277657D+00  0.188217D+00  0.124910D+01 -0.344482D+00 -0.371117D+00
      2   0.188217D+00 -0.672548D+00 -0.411208D+00 -0.371117D+00  0.326185D+00
      3   0.124910D+01 -0.411208D+00 -0.135220D+01  0.198028D+00  0.799001D+00
               141           142           143           144           145 
      1   0.198028D+00  0.169837D+01 -0.222540D+00 -0.147488D+01 -0.276682D+01
      2   0.799001D+00 -0.222540D+00  0.147863D+01  0.106267D+01  0.264598D+01
      3  -0.924022D+00 -0.147488D+01  0.106267D+01  0.901862D+01  0.258503D+00
               146           147           148           149           150 
      1   0.264598D+01  0.258503D+00  0.277180D+01 -0.302555D+01 -0.481023D+00
      2  -0.361739D+01 -0.742461D+00 -0.302555D+01  0.727582D+01  0.509034D+00
      3  -0.742461D+00 -0.848763D+00 -0.481023D+00  0.509034D+00  0.106980D+01
               151           152           153           154           155 
      1  -0.812385D+00  0.566901D+00 -0.397164D+00  0.374216D+01  0.235720D+01
      2   0.566901D+00 -0.114041D+01  0.899813D+00  0.235720D+01  0.266549D+01
      3  -0.397164D+00  0.899813D+00  0.604968D+00  0.251347D+01  0.145450D+01
               156           157           158           159           160 
      1   0.251347D+01  0.148363D+01  0.211092D+01  0.909286D+00  0.240661D+01
      2   0.145450D+01  0.211092D+01  0.298487D+01  0.183570D+01  0.136656D+01
      3   0.237844D+01  0.909286D+00  0.183570D+01  0.186112D+01  0.219315D+01
               161           162           163           164           165 
      1   0.136656D+01  0.219315D+01 -0.483802D+01 -0.176106D+01 -0.321235D+01
      2   0.215470D+01  0.240756D+01 -0.176106D+01 -0.218977D+01 -0.120483D+01
      3   0.240756D+01  0.352253D+01 -0.321235D+01 -0.120483D+01 -0.315363D+01
               166           167           168           169           170 
      1  -0.530679D+00 -0.883918D+00 -0.163800D+00 -0.288084D+01 -0.778306D+00
      2  -0.883918D+00 -0.491137D+00 -0.391477D+00 -0.778306D+00 -0.989430D+00
      3  -0.163800D+00 -0.391477D+00 -0.355244D+00 -0.237888D+01 -0.150688D+01
               171           172           173           174           175 
      1  -0.237888D+01 -0.704587D+00 -0.110012D+01  0.705819D-02 -0.997098D+00
      2  -0.150688D+01 -0.110012D+01 -0.965470D+00  0.417913D+00 -0.826020D+00
      3  -0.337622D+01  0.705819D-02  0.417913D+00 -0.439568D+00  0.302862D+00
               176           177           178           179           180 
      1  -0.826020D+00  0.302862D+00  0.666269D+00  0.819521D+00 -0.296507D+00
      2  -0.550186D+01  0.194521D+01  0.819521D+00  0.414906D+01 -0.189947D+01
      3   0.194521D+01 -0.178718D+01 -0.296507D+00 -0.189947D+01  0.261986D+01
               181           182           183           184           185 
      1   0.291610D+01 -0.152932D+01 -0.205706D+01 -0.986860D+00  0.123986D+01
      2  -0.152932D+01  0.272585D+01  0.167298D+01  0.123986D+01 -0.196018D+01
      3  -0.205706D+01  0.167298D+01  0.241324D+01  0.804395D+00 -0.940643D+00
               186           187           188           189           190 
      1   0.804395D+00 -0.199453D+01  0.979981D+00  0.136774D+01  0.104332D+01
      2  -0.940643D+00  0.979981D+00 -0.171512D+01 -0.205219D+01  0.751401D+00
      3  -0.124796D+01  0.136774D+01 -0.205219D+01 -0.320391D+01 -0.914459D+00
               191           192           193           194           195 
      1   0.751401D+00 -0.914459D+00  0.164143D+01  0.398702D+00 -0.437534D+00
      2   0.334901D+00 -0.249002D+00  0.398702D+00  0.891893D+00 -0.128924D+01
      3  -0.249002D+00  0.129775D+01 -0.437534D+00 -0.128924D+01  0.180635D+01
               196           197           198           199           200 
      1  -0.221086D+01 -0.102882D+00  0.188759D+01  0.127898D+01 -0.115242D+01
      2  -0.102882D+00 -0.167436D+01  0.150165D+01 -0.115242D+01  0.114516D+01
      3   0.188759D+01  0.150165D+01 -0.486881D+01  0.440023D-01  0.242965D+00
               201           202           203           204           205 
      1   0.440023D-01 -0.296308D+01  0.278198D+01  0.558796D+00  0.434162D-01
      2   0.242965D+00  0.278198D+01 -0.714600D+01 -0.114425D+01  0.382266D+00
      3   0.382714D+00  0.558796D+00 -0.114425D+01 -0.116902D+01  0.716015D+00
               206           207           208           209           210 
      1   0.382266D+00  0.716015D+00  0.721538D+01  0.797979D+00  0.248039D+01
      2  -0.975334D+00 -0.765000D+00  0.797979D+00  0.108532D+01  0.229304D+00
      3  -0.765000D+00 -0.708692D+00  0.248039D+01  0.229304D+00  0.177125D+01
               211           212           213           214           215 
      1   0.234350D+01  0.135564D+01  0.681439D+00  0.496798D+01  0.339818D+00
      2   0.135564D+01  0.212034D+00  0.352128D+00  0.339818D+00  0.768183D+00
      3   0.681439D+00  0.352128D+00  0.904727D+00  0.244964D+01  0.557534D+00
               216           217           218           219           220 
      1   0.244964D+01 -0.435654D+01  0.195319D-01  0.212393D+01  0.148885D+00
      2   0.557534D+00  0.195319D-01 -0.135244D+01  0.937766D+00 -0.613084D+00
      3   0.212422D+01  0.212393D+01  0.937766D+00 -0.293405D+01  0.355447D+00
               221           222           223           224           225 
      1  -0.613084D+00  0.355447D+00  0.192472D+01  0.312166D+00 -0.146089D+01
      2  -0.532473D+00  0.288950D+00  0.312166D+00  0.436906D+00 -0.184154D+00
      3   0.288950D+00  0.222681D+00 -0.146089D+01 -0.184154D+00  0.274937D+01
               226           227           228           229           230 
      1   0.344664D+01  0.134656D+00  0.323131D+01  0.116237D+01  0.774295D+00
      2   0.134656D+00  0.113127D+01 -0.359498D-01  0.774295D+00  0.997846D-01
      3   0.323131D+01 -0.359498D-01  0.399803D+01  0.971830D+00  0.636303D+00
               231           232           233           234           235 
      1   0.971830D+00  0.261542D+01  0.103220D+00  0.291818D+01  0.624326D+00
      2   0.636303D+00  0.103220D+00  0.678705D+00  0.302642D+00 -0.109971D+01
      3   0.202645D+01  0.291818D+01  0.302642D+00  0.567281D+01  0.577410D+00
               236           237           238           239           240 
      1  -0.109971D+01  0.577410D+00 -0.144108D+01  0.158963D+01 -0.267628D+00
      2   0.140079D+01 -0.179837D+00  0.158963D+01 -0.833794D+01  0.118555D+01
      3  -0.179837D+00  0.567569D+00 -0.267628D+00  0.118555D+01 -0.160290D+01
               241           242           243 
      1   0.848094D-01  0.224660D+00  0.256840D+00
      2   0.224660D+00 -0.776295D+00 -0.489868D+00
      3   0.256840D+00 -0.489868D+00 -0.178304D+00
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.125205D+01  0.971308D+00  0.161888D+01  0.225265D+01 -0.549836D+01
      2   0.858888D+01 -0.167170D+00  0.373014D+01  0.161522D+01 -0.398631D+01
      3   0.931675D+00 -0.652423D+01 -0.185020D+01  0.102417D+01  0.681452D+01
                 6             7             8             9            10 
      1  -0.353965D+01  0.406732D+01  0.370465D+01  0.167660D+01 -0.422595D+01
      2   0.273798D+01 -0.307355D+01  0.305740D+01 -0.251092D+01 -0.202042D+01
      3   0.263399D+01 -0.215702D+01  0.276028D+01 -0.324841D+01 -0.223232D+01
                11            12            13            14            15 
      1  -0.266392D+01  0.122045D+01  0.129797D+01  0.446207D+01 -0.106590D+02
      2  -0.324267D+01  0.204823D+01 -0.321488D+01 -0.350710D+00  0.126607D+01
      3  -0.326767D+01  0.370555D+01  0.681718D+01  0.414942D+00  0.124520D+01
                16            17            18            19            20 
      1  -0.514837D+01  0.153894D+00 -0.244785D+01  0.435189D+01  0.410222D+01
      2  -0.595791D+01  0.370690D+01 -0.563581D+01  0.507405D+01 -0.112712D+01
      3   0.335880D+01  0.277599D+01 -0.207002D+00 -0.379603D+00 -0.434789D+01
                21            22            23            24            25 
      1   0.411413D+01 -0.704662D+00  0.163823D+01  0.513155D+01  0.461667D+01
      2   0.112021D+02 -0.755893D+00 -0.657243D+00 -0.766703D+01  0.382944D+01
      3   0.394533D+00  0.578635D+00 -0.209798D+00 -0.155431D+01  0.745783D+00
                26            27            28            29            30 
      1   0.958327D+01 -0.981586D+00 -0.496938D+01 -0.640742D+01 -0.106130D+01
      2  -0.741037D+01  0.664851D+00 -0.211821D+01 -0.188243D+01  0.491759D+01
      3  -0.170395D+01  0.521342D+00 -0.848083D+01 -0.124370D+02  0.581639D+01
                31            32            33            34            35 
      1  -0.579838D+01 -0.199526D+01 -0.104277D+02 -0.370568D+00 -0.483999D+01
      2  -0.533784D+00  0.471155D+01  0.289405D+01  0.565192D+00  0.209445D+01
      3  -0.356170D+01  0.119642D+02  0.529270D+00  0.525537D+01  0.154605D+01
                36            37            38            39            40 
      1   0.608710D+01  0.368079D+01  0.946463D+00  0.508633D+00  0.473237D+00
      2  -0.416181D+01 -0.550262D+01 -0.103288D+01  0.418856D+01 -0.107730D+01
      3  -0.150469D+01  0.489886D+01 -0.251803D+01 -0.374813D+01  0.555319D+01
                41            42            43            44            45 
      1   0.504823D+01  0.863244D+00 -0.604691D+00  0.815171D+01 -0.722647D+01
      2   0.173774D+01 -0.128865D+01 -0.247245D+01 -0.678897D+00  0.310519D+01
      3  -0.895468D+01 -0.152764D+01 -0.328735D+01 -0.167359D+01 -0.386370D+00
                46            47            48            49            50 
      1   0.319375D+01  0.188185D+01  0.481338D+01  0.387396D+01 -0.131871D+02
      2  -0.297426D+01  0.657773D+01 -0.295717D+01  0.564264D+01 -0.324649D+01
      3  -0.261727D+00  0.207419D+01 -0.609037D+01  0.572818D+01  0.242592D+01
                51            52            53            54            55 
      1  -0.162091D+01  0.128868D+01  0.103329D+02  0.140170D+02 -0.480982D+01
      2  -0.997850D+00 -0.105356D+02  0.102130D+01  0.548574D+01  0.232034D+01
      3  -0.225715D+01 -0.654315D+01 -0.263652D+01  0.398034D+00 -0.472045D+01
                56            57            58            59            60 
      1   0.612059D+01 -0.236463D+01  0.461496D+01 -0.533500D+01 -0.605883D+01
      2   0.900869D+00 -0.384658D+01  0.888224D+00 -0.625827D+01 -0.189095D+01
      3   0.351129D+01  0.491769D+01  0.662362D+01  0.114528D+01  0.101965D+01
                61            62            63            64            65 
      1  -0.492506D+00  0.492574D+01  0.112945D+02  0.675022D+01 -0.157793D+01
      2  -0.772379D+01  0.209256D+00  0.770080D+01 -0.215807D+01  0.450092D+01
      3   0.346187D+01 -0.464538D+00  0.270325D+01 -0.188515D+01 -0.907353D+01
                66            67            68            69            70 
      1   0.365315D+01 -0.267019D+01 -0.683106D+01  0.765540D+01  0.293025D+01
      2   0.774136D+01  0.273160D+01  0.189338D+01 -0.393018D+01  0.251101D+01
      3  -0.127592D+02 -0.193542D+01  0.166018D+01  0.806194D+00 -0.104342D+02
                71            72            73            74            75 
      1   0.146190D+02 -0.237634D+01 -0.124676D+00 -0.697559D+00 -0.470859D+01
      2  -0.528987D+01  0.704184D+00  0.341295D+01  0.944506D+00  0.132684D+02
      3  -0.115595D+00  0.872295D-01 -0.313076D+01 -0.145923D+02 -0.360394D+00
                76            77            78            79            80 
      1  -0.264930D+01  0.238381D+01 -0.152171D+01  0.973323D+00 -0.129339D+01
      2  -0.130791D+01  0.285524D+01  0.356701D+01  0.422073D+01  0.502745D+00
      3  -0.304875D+01 -0.761561D+01  0.249158D-01  0.506562D+00  0.686102D+00
                81            82            83            84            85 
      1  -0.510464D+01 -0.222345D+01  0.995054D-01 -0.184657D+01  0.230415D-01
      2  -0.159890D+01 -0.115349D+02 -0.621966D+00 -0.515631D+01 -0.194254D+01
      3  -0.262403D+01  0.562259D+01  0.398036D+01  0.304664D+01  0.117429D+02
                86            87            88            89            90 
      1   0.693504D+00 -0.463522D+01 -0.376445D+01 -0.495469D+00  0.304731D+01
      2   0.552686D+01 -0.792358D+01 -0.125126D+02 -0.721359D+01  0.838225D+01
      3  -0.149363D+02 -0.585623D+01  0.436297D+01 -0.558660D+01  0.976496D+01
                91            92            93            94            95 
      1  -0.858374D+01 -0.418735D+01 -0.361631D+01 -0.605856D+01  0.158495D+02
      2  -0.101051D+02 -0.477506D+00  0.127270D+02 -0.135612D+00  0.485390D+01
      3  -0.293670D+01 -0.858145D-01  0.867997D+01  0.443464D+01 -0.376193D+01
                96            97            98            99           100 
      1  -0.541427D+01 -0.378814D+01  0.270331D+01 -0.860318D+01  0.499068D+00
      2  -0.100612D+01  0.628660D+01 -0.159521D+01  0.273619D+01  0.649260D+01
      3   0.917566D-01  0.709302D+01 -0.131245D+01  0.481908D+01  0.103033D+01
               101           102           103           104           105 
      1  -0.480091D+01 -0.229360D+01 -0.428250D+00  0.404949D+01 -0.178985D+00
      2  -0.145825D+01 -0.296791D+01 -0.269505D+01  0.132693D+01  0.161541D+01
      3  -0.145114D+01 -0.881155D+00  0.727813D+00  0.307144D+00  0.240133D+00
               106           107           108           109           110 
      1  -0.169251D+01  0.522569D+01  0.329674D+01 -0.243172D+00  0.402916D+01
      2  -0.599970D+01  0.140710D+01  0.329986D+01 -0.109501D+02  0.145903D+01
      3  -0.345153D+00  0.135099D+01  0.647285D+00 -0.300595D+01 -0.195130D+01
               111           112           113           114           115 
      1  -0.249770D+00  0.106439D+01 -0.169147D+01 -0.395787D+00  0.143031D+00
      2  -0.403944D+01  0.232487D+01 -0.172580D+01  0.186570D+01 -0.542163D+01
      3  -0.162814D+01  0.147660D+01  0.157561D+00  0.576989D+00 -0.148249D+01
               116           117           118           119           120 
      1   0.190250D+01  0.413846D+00 -0.457233D+00  0.306066D+01  0.306132D+01
      2   0.153123D+01 -0.347154D+01 -0.199542D+01  0.223169D+01  0.872784D-01
      3  -0.544126D+00 -0.135376D+01 -0.492622D+01  0.605756D+01 -0.167469D+01
               121           122           123           124           125 
      1   0.188983D+01 -0.562448D+01 -0.449695D+01  0.998136D+00  0.169324D+00
      2   0.216264D+01 -0.336032D+01  0.467436D+00 -0.141710D+01  0.990857D+00
      3   0.778066D+01 -0.100645D+02  0.142620D+01 -0.912505D+00  0.735459D+00
               126           127           128           129           130 
      1  -0.695630D+00  0.270116D+01 -0.941976D+00 -0.477854D+01  0.198764D+00
      2  -0.263037D+00  0.625348D+01  0.137094D+01  0.189953D+01  0.922571D+00
      3  -0.189280D+01  0.146641D+02  0.113873D+01 -0.362540D+01  0.295336D+01
               131           132           133           134           135 
      1   0.449443D+00 -0.897316D+00 -0.265427D+01  0.135285D+01  0.189435D+01
      2   0.651778D+00  0.209455D+00 -0.217983D+01 -0.452149D+00 -0.281706D+00
      3   0.103928D+01 -0.103193D+01 -0.408727D+01 -0.686438D+00  0.299786D+01
               136           137           138           139           140 
      1  -0.132780D+01  0.368130D+00  0.262104D+01  0.370225D+00 -0.134517D+01
      2  -0.123756D+01  0.643894D+00  0.148304D+01  0.635409D+00 -0.163484D+00
      3   0.299050D+00 -0.206741D+01  0.764808D+00 -0.278877D-01 -0.133001D+01
               141           142           143           144           145 
      1   0.370383D+01  0.254414D+01  0.173853D+01 -0.170353D+02  0.334843D+01
      2   0.222865D+01 -0.319545D+01 -0.100766D+01 -0.993325D+01  0.334559D+01
      3   0.951678D+00  0.253285D+01  0.192807D+01 -0.249078D+01 -0.117094D+01
               146           147           148           149           150 
      1  -0.658631D+01  0.211092D+00 -0.399990D+01  0.109488D+02 -0.256666D+01
      2  -0.344280D+01  0.222298D+01 -0.385622D+01  0.531537D+01 -0.111098D+01
      3  -0.228738D+01 -0.884507D+00  0.387410D+01  0.452517D+01 -0.536747D+00
               151           152           153           154           155 
      1   0.105215D+01 -0.318421D+01  0.639650D+00 -0.203632D+01  0.140681D+01
      2   0.781604D+00 -0.177312D+01  0.605875D+00 -0.204135D+01 -0.590011D+00
      3  -0.129273D+01 -0.124564D+01  0.350720D+00  0.516445D+01 -0.715018D+00
               156           157           158           159           160 
      1  -0.354851D+01 -0.326067D+00 -0.105057D+00 -0.377314D+01 -0.185564D+01
      2   0.179966D+01 -0.149606D+01 -0.335442D+00  0.133854D+01 -0.218475D+01
      3   0.275815D+01  0.293390D+01  0.621393D+00  0.496778D+00  0.381447D+01
               161           162           163           164           165 
      1   0.484680D+00 -0.401461D+01 -0.410012D+01  0.159854D+01 -0.577755D+01
      2   0.992030D+00  0.214486D+01 -0.533724D+01 -0.887473D+00  0.462409D+00
      3  -0.770103D+00  0.138226D+01  0.108070D+02 -0.499066D+00  0.619798D+01
               166           167           168           169           170 
      1   0.783733D-01 -0.262536D+00 -0.141791D+01 -0.414097D+01  0.597720D-01
      2  -0.492449D+00 -0.101588D+01 -0.492254D-01 -0.363609D+01 -0.141906D+00
      3   0.145168D+01  0.164343D+01  0.727679D+00  0.658536D+01  0.324437D+00
               171           172           173           174           175 
      1  -0.506814D+01  0.125293D+01  0.198915D+01 -0.123248D+01  0.182841D+01
      2  -0.549380D-02 -0.525992D+00 -0.159547D+01  0.117818D+01 -0.712644D+00
      3   0.457391D+01  0.859943D+00  0.626594D+00 -0.135090D-01  0.378497D+01
               176           177           178           179           180 
      1   0.108562D+02 -0.954095D+01 -0.839186D+00 -0.821815D+01  0.110850D+02
      2  -0.267195D+01  0.211822D+01 -0.366640D+00  0.247097D+01 -0.331280D+01
      3  -0.203281D+01  0.772050D+00 -0.262858D+01  0.150764D+01 -0.111610D+01
               181           182           183           184           185 
      1  -0.253683D+01 -0.169144D+01  0.397298D+01  0.275933D+00  0.449014D+00
      2   0.712989D+01 -0.272485D+01 -0.257889D+01 -0.212917D+01  0.206835D+01
      3  -0.972777D+01  0.301986D+01  0.539834D+01  0.431642D+01 -0.313487D+01
               186           187           188           189           190 
      1  -0.293753D+01  0.172020D+01 -0.143133D+00 -0.398613D+01 -0.100740D+01
      2   0.141386D+01 -0.523771D+01  0.235305D+01  0.282915D+01 -0.205966D+01
      3  -0.239800D+01  0.602442D+01 -0.217323D+01 -0.418537D+01 -0.222602D+01
               191           192           193           194           195 
      1  -0.566138D+00  0.614969D+00 -0.453138D-02 -0.218214D+01  0.122806D+01
      2  -0.276370D+00  0.359284D+01  0.630969D+00 -0.423979D+01  0.650137D+01
      3  -0.176826D+01  0.138680D+01 -0.500927D-01 -0.438112D+01  0.463237D+01
               196           197           198           199           200 
      1   0.709632D+00  0.447318D+01 -0.359248D+01  0.339735D+00 -0.477968D+00
      2   0.647759D+00  0.572431D+01 -0.153608D+02  0.287709D+00  0.307504D+00
      3   0.646711D+00  0.663606D+01 -0.605733D+01  0.258260D+01 -0.337698D+01
               201           202           203           204           205 
      1   0.454847D+00 -0.694017D-01  0.145309D+01 -0.345924D+01  0.277333D+00
      2   0.167745D+01  0.563953D+00 -0.318050D+01 -0.433755D+01  0.687129D+00
      3  -0.694692D+00 -0.186952D+01  0.198496D+02  0.305158D+01 -0.793582D+00
               206           207           208           209           210 
      1   0.780968D+00 -0.624908D+00  0.174054D+01  0.844238D+00  0.880881D+00
      2  -0.167840D+01 -0.203737D+01  0.776424D+01  0.129080D+01  0.836048D+01
      3   0.322611D+01  0.156667D+01 -0.648012D+01 -0.588136D+01 -0.249067D+01
               211           212           213           214           215 
      1   0.619047D+00  0.682345D+00 -0.300060D+00  0.188838D+01  0.166505D+01
      2   0.194551D+01  0.971781D+00  0.352476D+01  0.523092D+01  0.180293D+01
      3  -0.341609D+01 -0.194312D+01 -0.118438D+01 -0.373705D+01 -0.380496D+01
               216           217           218           219           220 
      1   0.826844D+00  0.422440D+01 -0.367492D+01 -0.237894D+01 -0.159950D+01
      2   0.751601D+01  0.148989D+02 -0.693204D+00 -0.472557D+01 -0.628564D+00
      3  -0.319312D+01  0.799279D+01 -0.177380D+01 -0.323367D+01  0.612549D+00
               221           222           223           224           225 
      1   0.179352D-01 -0.760258D-01 -0.195738D+01  0.193357D+01  0.279722D+01
      2   0.198289D+01 -0.509933D+00 -0.741075D+01 -0.533578D+00  0.438936D+01
      3   0.112433D+01 -0.749345D+00 -0.328844D+01  0.145377D+00  0.219737D+01
               226           227           228           229           230 
      1   0.469626D+01  0.409608D+01  0.508290D+01  0.261472D+01  0.176916D+01
      2  -0.498504D+01 -0.864042D+00 -0.414096D+00 -0.214464D+01 -0.798773D+00
      3  -0.388721D+01 -0.323204D+01 -0.364311D+01 -0.125209D+01 -0.145065D+01
               231           232           233           234           235 
      1   0.262803D+01  0.407375D+01  0.415696D+01  0.776905D+01 -0.138536D+01
      2   0.661231D+00 -0.565359D+01  0.108227D-01  0.918790D-01 -0.156051D+00
      3  -0.155312D+01 -0.358782D+01 -0.190131D+01 -0.403749D+01  0.960374D-01
               236           237           238           239           240 
      1   0.275914D+01  0.102816D+01  0.296657D+01 -0.174627D+02 -0.378778D+01
      2   0.162592D+01  0.594231D+00  0.305912D+01 -0.190479D+01 -0.169771D+01
      3  -0.951120D+00 -0.261242D+00  0.349399D+01  0.662440D+01 -0.709178D+00
               241           242           243 
      1   0.528012D+00 -0.155042D+01 -0.231573D+01
      2  -0.528242D+00 -0.602590D+00 -0.951155D+00
      3   0.189093D+00  0.996475D+00  0.287263D+00
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.823326D+01  0.332030D+01  0.125751D+02  0.451096D+01  0.684123D+01
      2  -0.128628D+01 -0.257406D+01 -0.832885D+01 -0.391740D+01 -0.123340D+01
      3   0.951954D+01 -0.746240D+00 -0.424626D+01 -0.593552D+00 -0.560782D+01
      4  -0.904851D-01  0.408204D+01 -0.439680D+01  0.549250D+01 -0.110975D+02
      5   0.114899D+02 -0.878688D+00  0.762365D+01  0.850822D+00  0.446612D+00
      6  -0.670136D+01  0.220054D+01 -0.128153D+01  0.266324D+01 -0.456741D+01
                 6             7             8             9            10 
      1  -0.367070D+01  0.158434D+02 -0.237177D+01  0.877512D+01  0.108637D+01
      2  -0.336395D+01 -0.892783D+01 -0.156343D+01 -0.457752D+01 -0.835592D+00
      3   0.703466D+01 -0.691552D+01  0.393519D+01 -0.419760D+01 -0.250781D+00
      4  -0.371284D+00 -0.371513D+01  0.141670D+00  0.168256D+01  0.516171D+01
      5   0.532705D+01  0.883742D+01  0.456023D+01 -0.103929D+01 -0.143261D+01
      6  -0.309993D+01 -0.136438D+01 -0.364455D+01  0.269176D+01  0.646398D+01
                11            12            13            14            15 
      1   0.462662D+01  0.140197D+01  0.673594D+01 -0.112178D+01 -0.115814D+02
      2  -0.181666D+01  0.344579D+01  0.129580D+00  0.712018D+01 -0.285266D+01
      3  -0.280996D+01 -0.484776D+01 -0.686552D+01 -0.599840D+01  0.144341D+02
      4   0.325784D+01  0.312434D+01  0.383695D+00  0.157150D+01 -0.116013D+01
      5  -0.151813D+01  0.421601D+01 -0.171313D+01 -0.165995D+01 -0.379882D+01
      6  -0.153019D+01  0.656526D+00 -0.543355D+00  0.346460D+01 -0.324088D+01
                16            17            18            19            20 
      1  -0.128475D+02 -0.642830D+01 -0.201331D+01  0.629501D+01 -0.260258D+01
      2   0.477674D+01 -0.275192D+01  0.254626D+00  0.111108D+02 -0.994126D+01
      3   0.807080D+01  0.918021D+01  0.175868D+01 -0.174058D+02  0.125438D+02
      4   0.586891D+01 -0.399880D+01  0.208905D+01  0.397898D+01 -0.231199D+01
      5   0.234397D+01 -0.229170D+00  0.441825D+00 -0.914545D+01  0.280090D+01
      6  -0.252892D-02  0.753812D+00  0.992657D+01  0.398999D+01 -0.852315D+00
                21            22            23            24            25 
      1  -0.800882D+01 -0.982929D+01 -0.574354D+01  0.123129D+02 -0.162034D+01
      2  -0.383080D+01 -0.645343D+01 -0.481410D+01  0.125623D+01 -0.518672D+01
      3   0.118396D+02  0.162827D+02  0.105576D+02 -0.135691D+02  0.680706D+01
      4   0.305809D+01 -0.216351D+01 -0.261599D+01 -0.160196D+01  0.138643D+01
      5  -0.193523D+02  0.479287D+01  0.226230D+01  0.106181D+02 -0.129257D+02
      6   0.939611D+01 -0.245127D+01 -0.437846D+01  0.606467D+01  0.686011D+01
                26            27            28            29            30 
      1   0.629019D+01  0.291390D+01 -0.458424D+01 -0.147969D+02  0.558445D+01
      2   0.725873D+00  0.110115D+02 -0.589551D+01  0.233213D+02  0.475598D+00
      3  -0.701607D+01 -0.139254D+02  0.104797D+02 -0.852436D+01 -0.606005D+01
      4  -0.166897D+01  0.344449D+01 -0.167976D+02 -0.113173D+02  0.112936D+02
      5   0.709225D+01  0.282318D+01  0.110162D+02  0.746520D+01 -0.296620D+01
      6   0.425646D+01 -0.458000D+01  0.138691D+02 -0.106495D+01 -0.453539D+01
                31            32            33            34            35 
      1  -0.923507D+01  0.146933D+02 -0.182625D+00  0.458675D+01  0.124401D+01
      2   0.156914D+02 -0.218965D+02  0.808551D+01  0.547471D+00  0.685334D+01
      3  -0.645630D+01  0.720318D+01 -0.790288D+01 -0.513422D+01 -0.809734D+01
      4  -0.341412D+01  0.113464D+02  0.146566D+01  0.934394D+01  0.323808D+01
      5   0.278443D+01 -0.316961D+01  0.198592D+00 -0.381376D+01  0.540108D+00
      6  -0.150196D+01  0.860816D+01  0.131740D+01 -0.280270D+01  0.293866D+01
                36            37            38            39            40 
      1  -0.742861D+01  0.472009D+00  0.374646D+01 -0.336028D+00  0.244509D+01
      2   0.529610D+01  0.167169D+01 -0.840047D+01 -0.277921D+01 -0.518596D+01
      3   0.213251D+01 -0.214370D+01  0.465400D+01  0.311524D+01  0.274086D+01
      4   0.242393D+01  0.393830D+00 -0.672269D+01 -0.105402D+02 -0.586251D+01
      5  -0.122778D+01 -0.518209D+01 -0.798054D+01 -0.879718D+01 -0.431379D+01
      6  -0.887748D+01 -0.116236D+02 -0.101663D+02 -0.366690D+01 -0.753103D+01
                41            42            43            44            45 
      1  -0.787655D+01 -0.723200D-01 -0.282937D+01 -0.874083D+00  0.229096D+01
      2   0.113148D+02 -0.780109D+00  0.421503D+00 -0.916864D+00 -0.723171D+01
      3  -0.343829D+01  0.852429D+00  0.240787D+01  0.179095D+01  0.494075D+01
      4  -0.321555D+01 -0.492256D+01 -0.837676D+01 -0.488870D+01 -0.105870D+02
      5  -0.503166D+01 -0.671198D+01 -0.731921D+01 -0.855385D+01 -0.535645D+01
      6   0.318695D+00 -0.749641D+01 -0.603767D+01 -0.106400D+02  0.173023D+01
                46            47            48            49            50 
      1  -0.513974D+02 -0.615702D+01  0.345215D+01 -0.182507D+02  0.131995D+01
      2   0.243133D+02 -0.206919D+01 -0.359091D+01  0.876468D+01 -0.361689D+01
      3   0.270840D+02  0.822622D+01  0.138759D+00  0.948600D+01  0.229695D+01
      4  -0.129556D+02 -0.850614D+01  0.151378D+01  0.724113D+00 -0.427649D+01
      5   0.549834D+01  0.356296D+01 -0.799126D+01  0.279765D+01  0.168991D+00
      6   0.639790D+00  0.667412D+00 -0.566613D+01  0.319876D+01 -0.493356D+01
                51            52            53            54            55 
      1   0.115421D+02  0.107504D+01  0.949927D+01 -0.654529D+00  0.216106D+01
      2  -0.699245D+00  0.175929D+01 -0.555698D+01 -0.191908D+01 -0.637930D+01
      3  -0.108429D+02 -0.283433D+01 -0.394229D+01  0.257360D+01  0.421824D+01
      4   0.154199D+01 -0.977869D+00  0.341490D+01 -0.267880D+01  0.249652D+01
      5  -0.487025D+01  0.452611D+01 -0.926262D+00 -0.654716D+00 -0.165399D+01
      6  -0.281821D+01 -0.283411D+00  0.569843D+00 -0.609485D+01  0.353895D+01
                56            57            58            59            60 
      1  -0.736101D+01 -0.675714D+01  0.167572D+01 -0.199512D+01 -0.826923D+01
      2   0.162311D+02  0.183914D+01  0.869198D+01 -0.112423D+02 -0.266311D+00
      3  -0.887008D+01  0.491800D+01 -0.103677D+02  0.132375D+02  0.853554D+01
      4  -0.124648D+02  0.156598D+00 -0.800894D+01  0.173054D+02 -0.106354D+01
      5  -0.153876D+01 -0.512632D-01 -0.126889D+00  0.317600D+01  0.818626D-01
      6   0.942751D+01  0.346190D+01  0.354202D+01  0.120274D+01  0.870708D+01
                61            62            63            64            65 
      1   0.236527D+01 -0.282420D+01  0.977200D+01  0.561503D+01 -0.535263D+01
      2  -0.538263D+01  0.805312D+01  0.148520D+02  0.394593D+01  0.233347D+01
      3   0.301736D+01 -0.522892D+01 -0.246240D+02 -0.956096D+01  0.301916D+01
      4   0.328832D+01 -0.315903D+01  0.594366D+01 -0.530250D+01 -0.881765D+01
      5   0.603763D+00  0.927345D+00  0.130011D+02 -0.872570D+01 -0.789209D+01
      6   0.123061D+01  0.543130D+01 -0.828491D+01 -0.200071D+02  0.746172D+01
                66            67            68            69            70 
      1  -0.932924D+01 -0.487854D+01 -0.147289D+01 -0.207550D+01 -0.752889D+01
      2   0.110491D+02  0.125605D+01 -0.421886D+01  0.167354D+02  0.100953D+02
      3  -0.171986D+01  0.362249D+01  0.569176D+01 -0.146599D+02 -0.256639D+01
      4  -0.181689D+02 -0.609611D+01  0.161916D+01  0.833001D+01 -0.157817D+02
      5  -0.170973D+02 -0.396718D+01  0.672513D+01  0.346827D+00 -0.141671D+02
      6  -0.465796D+00  0.696959D+01  0.131963D+02 -0.621418D+01 -0.381797D+00
                71            72            73            74            75 
      1  -0.535235D+01  0.317480D+01  0.104015D+03  0.130717D+02 -0.412347D+01
      2   0.198709D+02 -0.736643D+01 -0.504869D+02 -0.326564D+01  0.311646D+01
      3  -0.145185D+02  0.419163D+01 -0.535280D+02 -0.980604D+01  0.100702D+01
      4   0.933758D+01 -0.428438D+01  0.177688D+02  0.212543D+02 -0.985392D+00
      5  -0.850418D+00 -0.134705D+01 -0.880785D+01 -0.177318D+01  0.188771D+02
      6  -0.995279D+01 -0.615187D+01 -0.487216D+01 -0.261230D+01  0.350522D+01
                76            77            78            79            80 
      1   0.160751D+02  0.131415D+02 -0.315828D+01  0.186689D+01 -0.239547D+01
      2  -0.673468D+01 -0.121915D+01  0.188907D+01  0.168609D+01  0.108755D+01
      3  -0.934043D+01 -0.119224D+02  0.126921D+01 -0.355297D+01  0.130792D+01
      4   0.243296D+02  0.127379D+02 -0.282857D+01 -0.317993D+01 -0.202349D+01
      5  -0.482608D+01 -0.344014D+01  0.526966D+01  0.210531D+02  0.462693D+01
      6  -0.368622D+01 -0.188553D+01  0.550421D+01  0.249774D+01  0.442499D+01
                81            82            83            84            85 
      1   0.105592D+02 -0.469387D+01 -0.110787D+02 -0.236403D+02 -0.160409D+02
      2  -0.997933D+01  0.465654D+01  0.808982D+01  0.124531D+02  0.139873D+02
      3  -0.579844D+00  0.373295D-01  0.298889D+01  0.111872D+02  0.205365D+01
      4   0.394367D+01 -0.100002D+02 -0.587433D+01  0.107315D+01 -0.988403D+01
      5  -0.460132D+01 -0.239428D+02 -0.100100D+01 -0.104053D+02 -0.402681D+01
      6  -0.767399D+00  0.406117D+01  0.103738D+01  0.110375D+01  0.178849D+01
                86            87            88            89            90 
      1  -0.958182D+00 -0.849594D+00 -0.287541D+02 -0.748458D+00 -0.133600D+02
      2  -0.931908D+01 -0.247575D+01  0.146843D+02 -0.268957D+01  0.106199D+02
      3   0.102773D+02  0.332535D+01  0.140698D+02  0.343803D+01  0.274007D+01
      4   0.260378D+02  0.693000D+01 -0.113171D+01  0.661927D+01 -0.964583D+01
      5   0.703271D+01 -0.121301D+02 -0.149616D+02 -0.112430D+02  0.886866D+01
      6  -0.555000D+01  0.134826D+01  0.684831D+00  0.161822D+01 -0.837665D+00
                91            92            93            94            95 
      1   0.105236D+02 -0.246415D+01 -0.785908D+01 -0.363476D+01  0.354529D+01
      2   0.107819D+02  0.835271D+01  0.130427D+02  0.109261D+02 -0.231731D+02
      3  -0.213055D+02 -0.588855D+01 -0.518364D+01 -0.729129D+01  0.196278D+02
      4  -0.549139D+01 -0.173442D+01  0.641526D+01 -0.228914D+01  0.140709D+02
      5  -0.343816D+01 -0.221653D+01 -0.221159D+02 -0.498405D+01 -0.307079D+01
      6   0.472007D+01 -0.265572D+01 -0.307697D+01 -0.411023D+01  0.116752D+02
                96            97            98            99           100 
      1   0.492020D+01 -0.788803D+01  0.645501D+01 -0.931863D+01 -0.117525D+01
      2   0.738032D+01  0.132172D+02  0.605405D+00  0.137359D+02 -0.901702D+01
      3  -0.123005D+02 -0.532918D+01 -0.706042D+01 -0.441723D+01  0.101923D+02
      4   0.159670D+01  0.572707D+01  0.385927D+01 -0.229157D+01 -0.111163D+01
      5  -0.954608D+01 -0.203232D+02 -0.653814D+01 -0.962021D+01 -0.100083D+02
      6   0.801674D+01 -0.125457D+01  0.917815D+01 -0.952211D+01 -0.146904D+00
               101           102           103           104           105 
      1  -0.336523D+00  0.724545D+01  0.237791D+01 -0.292215D+01 -0.766978D+01
      2   0.382192D+01  0.113880D+02  0.327984D+01 -0.144878D+01 -0.652648D+01
      3  -0.348540D+01 -0.186335D+02 -0.565776D+01  0.437092D+01  0.141963D+02
      4   0.221215D+01 -0.273917D+00  0.177225D+01 -0.103841D+01 -0.123991D+01
      5   0.196747D+01  0.145538D+02  0.278132D+01 -0.360357D+01 -0.445729D+01
      6  -0.460789D+01 -0.789623D+00 -0.244823D+01  0.513287D+01  0.612335D+01
               106           107           108           109           110 
      1   0.383954D+01 -0.232813D+01 -0.169547D+02  0.362114D+01  0.198949D+01
      2   0.746209D+01 -0.337000D+01 -0.216355D+02 -0.118998D+02  0.900297D+00
      3  -0.113016D+02  0.569814D+01  0.385902D+02  0.827862D+01 -0.288978D+01
      4  -0.255428D+00 -0.138149D+01 -0.106964D+01 -0.887604D+01  0.559847D+01
      5   0.114811D+02 -0.310194D+01 -0.136842D+02  0.218326D+02 -0.484582D+01
      6  -0.984870D+00  0.577145D+01  0.123482D+01 -0.712069D+01  0.751303D+01
               111           112           113           114           115 
      1  -0.306078D+01  0.131111D+01 -0.172387D+01  0.229144D+01 -0.174070D+01
      2  -0.104947D+02  0.103301D+01  0.146970D+01  0.175238D+00 -0.612066D+01
      3   0.135554D+02 -0.234413D+01  0.254167D+00 -0.246668D+01  0.786136D+01
      4  -0.668593D+01  0.573266D+01 -0.268774D+01  0.348969D+01 -0.399125D+01
      5   0.200498D+02 -0.424849D+01  0.409899D+01 -0.455252D+01  0.130256D+02
      6  -0.902968D+01  0.527351D+01 -0.554259D+01  0.736788D+01 -0.566867D+01
               116           117           118           119           120 
      1   0.167485D+01 -0.704554D+01 -0.257635D+01  0.118135D+02 -0.378573D+01
      2   0.167551D+00 -0.117126D+02  0.825579D+01 -0.212400D+02  0.259474D+01
      3  -0.184240D+01  0.187581D+02 -0.567944D+01  0.942653D+01  0.119099D+01
      4   0.208528D+01 -0.484656D+01 -0.556089D+01  0.112497D+02 -0.297976D+01
      5  -0.391981D+01  0.132202D+02  0.124957D+01 -0.368102D+01  0.231618D+01
      6   0.522780D+01 -0.769611D+01 -0.511768D+01  0.851987D+01 -0.527648D+01
               121           122           123           124           125 
      1   0.654883D+01 -0.301979D+02  0.618040D+01 -0.133045D+01  0.361909D+01
      2  -0.107257D+02  0.546530D+02 -0.785427D+01  0.182520D+00 -0.307210D+01
      3   0.417689D+01 -0.244551D+02  0.167387D+01  0.114793D+01 -0.546991D+00
      4   0.909452D+01 -0.723417D+01  0.588838D+00 -0.154748D+01  0.398895D+00
      5  -0.298547D+01  0.232625D+01 -0.601212D+00  0.210612D+01 -0.614473D+00
      6   0.336735D+01 -0.200246D+02  0.110643D+02 -0.241065D+01  0.100415D+02
               126           127           128           129           130 
      1  -0.484697D+01  0.173907D+02  0.240435D+01 -0.147084D+01  0.150878D+01
      2   0.463661D+01 -0.267365D+01  0.553747D+01  0.731272D+00  0.292030D+01
      3   0.210356D+00 -0.147170D+02 -0.794182D+01  0.739570D+00 -0.442908D+01
      4  -0.214887D+01  0.294081D+02  0.193370D+02 -0.106606D+02  0.117290D+02
      5   0.932959D+00 -0.177728D+02 -0.861476D+01  0.103740D+02 -0.405804D+01
      6  -0.337936D+01 -0.131682D+02 -0.966677D+01  0.106427D+02 -0.517190D+01
               131           132           133           134           135 
      1  -0.144314D+01  0.768634D+00 -0.208660D+01  0.108218D+01  0.614366D+00
      2   0.848463D+01 -0.299921D+01  0.184464D+01 -0.261724D+01 -0.301841D+01
      3  -0.704150D+01  0.223057D+01  0.241964D+00  0.153506D+01  0.240404D+01
      4   0.891992D+01 -0.431197D+01 -0.835418D+01 -0.554543D+01  0.681482D+01
      5  -0.408351D+01  0.273687D+01  0.100733D+02  0.452963D+01 -0.696044D+01
      6  -0.722227D+01  0.447942D+01  0.795965D+01  0.678119D+01 -0.696775D+01
               136           137           138           139           140 
      1  -0.771453D+00  0.112398D+01 -0.530548D-01  0.206240D+01 -0.307782D+01
      2  -0.389516D+01 -0.116227D+01  0.430772D+01 -0.284165D+01  0.109144D+01
      3   0.466661D+01  0.382839D-01 -0.425467D+01  0.779246D+00  0.198638D+01
      4  -0.130233D+01  0.421028D+01  0.364705D+01  0.119937D+01 -0.228133D+01
      5  -0.497978D+01  0.155885D+01  0.103029D+02 -0.212250D+01 -0.191375D+01
      6   0.211682D+01 -0.233141D+01 -0.262724D+01 -0.105362D+01  0.175484D+01
               141           142           143           144           145 
      1   0.723737D-01 -0.108611D+01 -0.524778D+01 -0.230322D+02  0.597369D+01
      2   0.564903D+01  0.523128D+01  0.910300D+00 -0.216206D+02  0.511701D+01
      3  -0.572141D+01 -0.414517D+01  0.433748D+01  0.446527D+02 -0.110907D+02
      4  -0.114509D+01  0.388300D+01 -0.303621D+01 -0.670673D+01 -0.164140D+02
      5   0.326880D+01  0.957927D+01 -0.318748D+01 -0.203769D+02 -0.414123D+01
      6   0.441120D+01 -0.402079D+01  0.901065D+01  0.204924D+02  0.378622D+01
               146           147           148           149           150 
      1   0.301288D+00  0.154221D+01 -0.163928D+00 -0.126033D+02 -0.192037D+01
      2  -0.111151D+02 -0.132020D+01 -0.102318D+02  0.339875D+02  0.147035D+01
      3   0.108138D+02 -0.222007D+00  0.103957D+02 -0.213843D+02  0.450013D+00
      4   0.209675D+02  0.336696D+01  0.174436D+02 -0.277890D+02 -0.283713D+01
      5   0.567373D+01  0.414584D+01  0.432320D+01 -0.430498D+01 -0.327461D+01
      6  -0.686357D+01 -0.417426D+01 -0.570610D+01  0.119669D+02  0.685896D+01
               151           152           153           154           155 
      1   0.242373D+01 -0.253056D+00 -0.357169D+01  0.598322D+01 -0.625344D+00
      2   0.785678D+00 -0.555410D+01  0.148372D+01 -0.852620D+00  0.548979D+01
      3  -0.320941D+01  0.580715D+01  0.208797D+01 -0.513060D+01 -0.486444D+01
      4  -0.367946D+01  0.436341D+01 -0.386883D+01  0.156959D+02  0.148318D+02
      5   0.128282D+01 -0.251342D+01 -0.124626D+01  0.135318D+02  0.825196D+01
      6  -0.208403D+01  0.449690D+01  0.196218D+01  0.105651D+02  0.936904D+01
               156           157           158           159           160 
      1   0.952532D+00 -0.139989D+01 -0.538785D+01 -0.366472D+01  0.730333D+00
      2  -0.130404D+01  0.524404D+01  0.111734D+02  0.437192D+01 -0.159879D+01
      3   0.351510D+00 -0.384415D+01 -0.578557D+01 -0.707199D+00  0.868453D+00
      4   0.103757D+02  0.116987D+02  0.123868D+02  0.741244D+01  0.943083D+01
      5   0.119464D+02  0.556671D+01  0.718681D+01  0.550805D+01  0.115748D+02
      6   0.956994D+01  0.740506D+01  0.114902D+02  0.118836D+02  0.910354D+01
               161           162           163           164           165 
      1  -0.437005D+01 -0.554172D+01  0.897319D+01 -0.212448D+01  0.108320D+01
      2   0.366195D+01 -0.480655D+00 -0.899997D+01  0.531100D+01 -0.773399D+01
      3   0.708103D+00  0.602238D+01  0.267716D-01 -0.318653D+01  0.665079D+01
      4   0.865668D+01  0.101239D+02  0.201212D+02  0.124680D+02  0.137941D+02
      5   0.766968D+01  0.128858D+02  0.206342D+02  0.759676D+01  0.179204D+02
      6   0.140654D+02  0.157839D+02  0.138079D+02  0.911554D+01  0.132357D+02
               166           167           168           169           170 
      1  -0.844720D+00 -0.670425D+00 -0.106427D+01  0.206406D+01 -0.250960D+01
      2   0.320823D+01  0.249415D+01  0.143744D+01 -0.716395D+01  0.538753D+00
      3  -0.236351D+01 -0.182372D+01 -0.373165D+00  0.509990D+01  0.197085D+01
      4   0.637152D+01  0.463695D+01  0.288901D+01  0.120847D+02  0.513821D+01
      5   0.187155D+01  0.326163D+01  0.102209D+01  0.153394D+02  0.476795D+01
      6   0.374397D+01  0.269714D+01  0.523655D+01  0.958248D+01  0.102285D+02
               171           172           173           174           175 
      1  -0.405846D+01 -0.509536D+00  0.139629D-01  0.481955D+00 -0.320148D+00
      2  -0.631606D+01  0.303020D+01  0.441466D+01 -0.271890D+01  0.447526D+01
      3   0.103745D+02 -0.252066D+01 -0.442863D+01  0.223694D+01 -0.415511D+01
      4   0.961218D+01  0.444900D+01  0.842044D+01 -0.118782D+01  0.799242D+01
      5   0.146228D+02  0.493023D+00  0.378969D+00  0.369001D+01  0.433111D+00
      6   0.140669D+02  0.415959D+00 -0.148828D+01  0.171754D+01 -0.132416D+01
               176           177           178           179           180 
      1  -0.139861D+02  0.379739D+01  0.267334D+00  0.918643D+01 -0.358643D+01
      2   0.349005D+02 -0.128668D+02 -0.376727D+01 -0.231893D+02  0.931269D+01
      3  -0.209144D+02  0.906942D+01  0.349994D+01  0.140029D+02 -0.572626D+01
      4   0.935747D+01 -0.377604D+01 -0.464014D+01 -0.775209D+01  0.342457D+01
      5  -0.221132D+01  0.178996D+01  0.229660D+01  0.224216D+01 -0.270376D+01
      6  -0.585650D+01  0.961125D+01  0.113314D+01  0.818853D+01 -0.120052D+02
               181           182           183           184           185 
      1  -0.268422D+01  0.957982D+01  0.911751D+01  0.442440D+01 -0.839820D+01
      2   0.242378D+00 -0.105143D+02 -0.197262D+01 -0.495098D+01  0.105724D+02
      3   0.244185D+01  0.934495D+00 -0.714488D+01  0.526580D+00 -0.217421D+01
      4  -0.134588D+02  0.864808D+01  0.953003D+01  0.646781D+01 -0.644660D+01
      5  -0.931081D+01  0.541928D+01  0.863141D+01  0.290632D+01 -0.434780D+01
      6   0.109054D+02 -0.131977D+02 -0.136059D+02 -0.659028D+01  0.939571D+01
               186           187           188           189           190 
      1  -0.596000D+01  0.550359D+01 -0.858350D+01 -0.117597D+02  0.667955D+01
      2   0.347863D+01 -0.135317D+01  0.462644D+01  0.758128D+00 -0.547713D+01
      3   0.248137D+01 -0.415042D+01  0.395706D+01  0.110016D+02 -0.120241D+01
      4  -0.488635D+01  0.904574D+01 -0.538808D+01 -0.584256D+01  0.321017D+01
      5  -0.245436D+01  0.816281D+01 -0.294156D+01 -0.561726D+01 -0.538063D+01
      6   0.104509D+02 -0.765567D+01  0.144995D+02  0.170783D+02 -0.940875D+00
               191           192           193           194           195 
      1   0.389009D+01 -0.366865D+01  0.928112D+01 -0.190263D+00 -0.112125D+01
      2  -0.258232D+01  0.437635D+01 -0.602526D+01  0.933578D+00  0.281888D+01
      3  -0.130778D+01 -0.707695D+00 -0.325586D+01 -0.743314D+00 -0.169763D+01
      4   0.306920D+01 -0.205101D+01  0.349773D+01  0.340478D+01 -0.568350D+01
      5  -0.290292D+01  0.105095D+02 -0.400869D+01 -0.555641D+01  0.921050D+01
      6  -0.611132D+00 -0.193113D+00 -0.355536D+00 -0.167323D+01  0.208685D+01
               196           197           198           199           200 
      1  -0.105448D+02  0.735270D-01  0.438940D+01  0.664969D+01 -0.478423D+01
      2   0.805825D+01  0.231259D+01 -0.121436D+02 -0.584379D+00  0.550212D-01
      3   0.248650D+01 -0.238612D+01  0.775418D+01 -0.606531D+01  0.472921D+01
      4  -0.678438D+00 -0.797923D+01  0.624121D+01 -0.738959D+01  0.112634D+02
      5   0.149130D+02  0.717533D+01 -0.248785D+02  0.303270D+00  0.247519D+01
      6  -0.992009D+00  0.324203D+01  0.834947D+00  0.124255D+01 -0.126018D+01
               201           202           203           204           205 
      1   0.965194D+00 -0.108389D+02 -0.255654D+01  0.452302D+00  0.116676D+01
      2  -0.721557D+00 -0.110983D+01  0.200229D+02  0.158238D+01 -0.890095D+00
      3  -0.243637D+00  0.119487D+02 -0.174664D+02 -0.203468D+01 -0.276663D+00
      4   0.214528D+01  0.206652D+02 -0.371447D+02 -0.568979D+01  0.294985D+01
      5   0.338093D+01  0.403472D+01 -0.514523D+01 -0.612390D+01  0.549585D+01
      6  -0.101856D+01 -0.243336D+01  0.700186D+01  0.659555D+01 -0.214982D+01
               206           207           208           209           210 
      1  -0.417583D-01  0.725707D+00  0.498035D+02  0.589416D+01  0.155296D+02
      2   0.157276D+01  0.247620D+00 -0.269197D+02 -0.357787D+01 -0.924555D+01
      3  -0.153100D+01 -0.973326D+00 -0.228838D+02 -0.231629D+01 -0.628406D+01
      4  -0.507972D+01 -0.370317D+01  0.252045D+01  0.826741D+01  0.953420D+00
      5  -0.390665D+01 -0.352820D+01  0.183359D+02  0.203264D+01  0.140526D+02
      6   0.574389D+01  0.223610D+01 -0.178722D+01  0.603498D+00 -0.144167D+01
               211           212           213           214           215 
      1   0.143523D+02  0.544574D+01  0.346508D+01  0.288413D+02  0.227404D+01
      2  -0.825514D+01 -0.123541D+01 -0.193727D+01 -0.167322D+02 -0.139119D+01
      3  -0.609716D+01 -0.421034D+01 -0.152781D+01 -0.121092D+02 -0.882844D+00
      4   0.969232D+01  0.217246D+01  0.292660D+01  0.774560D+00  0.566786D+01
      5   0.527155D+01  0.285363D+01  0.581362D+01  0.192937D+02  0.323094D+01
      6   0.102527D+01  0.145145D+01  0.161296D+01 -0.116100D+01  0.181771D+01
               216           217           218           219           220 
      1   0.116326D+02 -0.489936D+01 -0.407273D+01  0.110511D+02 -0.964685D+00
      2  -0.102551D+02 -0.427792D+01  0.133920D+01  0.398376D+01 -0.501983D+00
      3  -0.137752D+01  0.917728D+01  0.273352D+01 -0.150349D+02  0.146667D+01
      4   0.241444D+01  0.917305D+01  0.228258D+01 -0.491859D+01  0.234837D+01
      5   0.150576D+02 -0.155622D+02 -0.285139D+00  0.986659D+01  0.333336D+00
      6  -0.114146D+01 -0.342247D+01 -0.704444D+01  0.867774D+01 -0.315748D+01
               221           222           223           224           225 
      1  -0.231752D+01  0.639311D+00  0.664925D+01  0.138358D+01 -0.868976D+01
      2   0.327830D+01 -0.211799D+01  0.201281D+01 -0.743465D+00 -0.750474D+01
      3  -0.960773D+00  0.147867D+01 -0.866205D+01 -0.640114D+00  0.161945D+02
      4  -0.720013D-01 -0.983633D+00 -0.450397D+01 -0.138782D+01  0.351994D+01
      5  -0.207597D+01  0.236598D+01  0.103889D+02  0.136404D+01 -0.569768D+01
      6  -0.225953D+01  0.254402D+01  0.381760D+01  0.364114D+01 -0.542218D+01
               226           227           228           229           230 
      1   0.821354D+01  0.183571D+01  0.942714D+00  0.298768D+01 -0.470843D+00
      2  -0.163505D+02 -0.323989D+01 -0.171097D+02 -0.627609D+01 -0.252338D+00
      3   0.813691D+01  0.140418D+01  0.161670D+02  0.328841D+01  0.723181D+00
      4  -0.390645D+01  0.422934D+01 -0.434056D+01  0.232629D+01  0.349103D+00
      5   0.223781D+02  0.701639D+00  0.245610D+02  0.718954D+01  0.446518D+01
      6  -0.208766D+01  0.566360D+01 -0.368130D+01  0.355161D+01  0.164819D+01
               231           232           233           234           235 
      1  -0.158625D+01  0.172643D+01  0.196936D+00 -0.721980D+01  0.532079D-01
      2  -0.785053D+01 -0.137622D+02 -0.238187D+01 -0.232155D+02  0.171353D+01
      3   0.943678D+01  0.120357D+02  0.218493D+01  0.304353D+02 -0.176673D+01
      4   0.198210D+01 -0.393906D+01  0.227728D+01 -0.279328D+01 -0.471813D+01
      5   0.825869D+01  0.200653D+02  0.131393D+01  0.255308D+02  0.245597D+01
      6   0.377437D+01 -0.220621D+01  0.531616D+01 -0.466604D+01 -0.312693D+01
               236           237           238           239           240 
      1  -0.519010D+00 -0.185981D+00 -0.563833D+00 -0.177257D+02  0.537915D+01
      2  -0.436669D+01 -0.147576D+01 -0.506170D+01  0.378787D+02 -0.168990D+01
      3   0.488570D+01  0.166175D+01  0.562553D+01 -0.201530D+02 -0.368924D+01
      4   0.887888D+01 -0.172039D+01  0.102450D+02 -0.190151D+02  0.308298D+01
      5  -0.321950D+01  0.474440D+01 -0.455600D+01  0.561048D+01 -0.329552D+01
      6   0.437402D+01 -0.143661D+01  0.527040D+01 -0.255736D+02  0.107957D+02
               241           242           243 
      1  -0.515791D+00  0.324416D+00 -0.108990D+01
      2  -0.170270D+01  0.378654D+01  0.144420D+01
      3   0.221849D+01 -0.411096D+01 -0.354297D+00
      4   0.969170D+00 -0.190935D+01 -0.121120D+01
      5   0.255583D+01 -0.512315D+00  0.889630D+00
      6  -0.406905D+00  0.377272D+01 -0.106228D+00
 End of Minotr F.D. properties file   788 does not exist.
 Leave Link 1002 at Fri Jul 16 22:02:56 2021, MaxMem=  5637144576 cpu:           73632.0 elap:            9278.7
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l601.exe)
 Copying SCF densities to generalized density rwf, IOpCl= 0 IROHF=0.

 **********************************************************************

            Population analysis using the SCF density.

 **********************************************************************

 Orbital symmetries:
       Occupied  (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A)
       Virtual   (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A)
 The electronic state is 1-A.
 Alpha  occ. eigenvalues --  -18.91015 -10.12223 -10.06082 -10.05374 -10.04977
 Alpha  occ. eigenvalues --  -10.04443 -10.04170 -10.04059 -10.03192 -10.03168
 Alpha  occ. eigenvalues --  -10.02646  -1.12744  -0.99252  -0.87436  -0.86754
 Alpha  occ. eigenvalues --   -0.84129  -0.78438  -0.76864  -0.74302  -0.68595
 Alpha  occ. eigenvalues --   -0.64335  -0.60235  -0.59115  -0.58754  -0.56944
 Alpha  occ. eigenvalues --   -0.54508  -0.52187  -0.50848  -0.50331  -0.49626
 Alpha  occ. eigenvalues --   -0.49048  -0.48141  -0.47585  -0.46569  -0.45434
 Alpha  occ. eigenvalues --   -0.43746  -0.43518  -0.42590  -0.41387  -0.40303
 Alpha  occ. eigenvalues --   -0.38693  -0.32463
 Alpha virt. eigenvalues --    0.02759   0.03555   0.03733   0.04150   0.04689
 Alpha virt. eigenvalues --    0.05557   0.05718   0.05852   0.06442   0.06547
 Alpha virt. eigenvalues --    0.07795   0.08029   0.08466   0.08810   0.08947
 Alpha virt. eigenvalues --    0.09111   0.09929   0.11603   0.11662   0.12328
 Alpha virt. eigenvalues --    0.12994   0.13283   0.13555   0.14045   0.14452
 Alpha virt. eigenvalues --    0.14785   0.15274   0.15353   0.15750   0.15956
 Alpha virt. eigenvalues --    0.16033   0.16204   0.16921   0.16985   0.17905
 Alpha virt. eigenvalues --    0.18007   0.18333   0.18866   0.19648   0.20024
 Alpha virt. eigenvalues --    0.20294   0.20825   0.21131   0.21417   0.21756
 Alpha virt. eigenvalues --    0.22460   0.22636   0.23399   0.23519   0.23879
 Alpha virt. eigenvalues --    0.24518   0.24990   0.25425   0.25574   0.26489
 Alpha virt. eigenvalues --    0.27518   0.27790   0.28075   0.28207   0.28583
 Alpha virt. eigenvalues --    0.29240   0.30319   0.30675   0.30863   0.31798
 Alpha virt. eigenvalues --    0.32303   0.32525   0.33386   0.34162   0.35036
 Alpha virt. eigenvalues --    0.35259   0.35513   0.36020   0.36431   0.36573
 Alpha virt. eigenvalues --    0.37364   0.38184   0.38531   0.39011   0.39674
 Alpha virt. eigenvalues --    0.40273   0.40543   0.41003   0.41249   0.42317
 Alpha virt. eigenvalues --    0.42741   0.43676   0.44225   0.44788   0.44803
 Alpha virt. eigenvalues --    0.45361   0.46095   0.46643   0.47291   0.47387
 Alpha virt. eigenvalues --    0.47478   0.47790   0.48364   0.48589   0.49677
 Alpha virt. eigenvalues --    0.50305   0.51154   0.51301   0.51933   0.52729
 Alpha virt. eigenvalues --    0.53462   0.54093   0.55214   0.55762   0.56099
 Alpha virt. eigenvalues --    0.56612   0.57429   0.58645   0.58980   0.59400
 Alpha virt. eigenvalues --    0.59691   0.60587   0.60708   0.61461   0.62759
 Alpha virt. eigenvalues --    0.62931   0.63729   0.64116   0.64394   0.65264
 Alpha virt. eigenvalues --    0.65642   0.65784   0.66051   0.66856   0.67004
 Alpha virt. eigenvalues --    0.67448   0.68293   0.68859   0.69435   0.69816
 Alpha virt. eigenvalues --    0.70437   0.70995   0.71876   0.72555   0.73043
 Alpha virt. eigenvalues --    0.73201   0.74304   0.74471   0.75111   0.75560
 Alpha virt. eigenvalues --    0.75728   0.76823   0.77323   0.78327   0.78677
 Alpha virt. eigenvalues --    0.79206   0.79524   0.80085   0.80761   0.81270
 Alpha virt. eigenvalues --    0.82036   0.82668   0.83142   0.83910   0.84246
 Alpha virt. eigenvalues --    0.85455   0.85631   0.86697   0.87047   0.88008
 Alpha virt. eigenvalues --    0.88232   0.88882   0.89346   0.90182   0.90774
 Alpha virt. eigenvalues --    0.91778   0.92593   0.93249   0.93354   0.94120
 Alpha virt. eigenvalues --    0.96318   0.96756   0.97498   0.98723   0.98889
 Alpha virt. eigenvalues --    0.99631   1.00675   1.01353   1.02538   1.03675
 Alpha virt. eigenvalues --    1.04276   1.07324   1.08447   1.08982   1.09569
 Alpha virt. eigenvalues --    1.11162   1.12079   1.12427   1.14845   1.15668
 Alpha virt. eigenvalues --    1.16957   1.19235   1.19635   1.20776   1.22049
 Alpha virt. eigenvalues --    1.23012   1.24860   1.25128   1.25592   1.26843
 Alpha virt. eigenvalues --    1.29036   1.29573   1.30023   1.31079   1.32440
 Alpha virt. eigenvalues --    1.32508   1.35667   1.36993   1.38614   1.40199
 Alpha virt. eigenvalues --    1.40886   1.42153   1.44474   1.47193   1.48824
 Alpha virt. eigenvalues --    1.49093   1.50982   1.52257   1.54586   1.54945
 Alpha virt. eigenvalues --    1.56625   1.57977   1.58529   1.59164   1.60483
 Alpha virt. eigenvalues --    1.61925   1.63787   1.64628   1.65618   1.66370
 Alpha virt. eigenvalues --    1.66440   1.67764   1.68805   1.69777   1.71872
 Alpha virt. eigenvalues --    1.73074   1.73620   1.75940   1.76496   1.78271
 Alpha virt. eigenvalues --    1.79709   1.80350   1.81730   1.82255   1.83047
 Alpha virt. eigenvalues --    1.84397   1.85900   1.86710   1.87975   1.89458
 Alpha virt. eigenvalues --    1.89632   1.90803   1.91114   1.93368   1.93680
 Alpha virt. eigenvalues --    1.94318   1.94672   1.95917   1.97394   1.97954
 Alpha virt. eigenvalues --    1.99030   1.99665   2.02390   2.02606   2.03508
 Alpha virt. eigenvalues --    2.04619   2.05600   2.07464   2.09271   2.09442
 Alpha virt. eigenvalues --    2.11536   2.12236   2.13070   2.14280   2.15676
 Alpha virt. eigenvalues --    2.16937   2.17657   2.18367   2.19361   2.20950
 Alpha virt. eigenvalues --    2.21695   2.22878   2.24619   2.27784   2.28249
 Alpha virt. eigenvalues --    2.28741   2.30096   2.31375   2.31773   2.33972
 Alpha virt. eigenvalues --    2.35138   2.36756   2.38164   2.39369   2.41207
 Alpha virt. eigenvalues --    2.42477   2.44068   2.44892   2.46185   2.46341
 Alpha virt. eigenvalues --    2.47379   2.49769   2.51314   2.52419   2.53694
 Alpha virt. eigenvalues --    2.55347   2.55782   2.57932   2.58320   2.60605
 Alpha virt. eigenvalues --    2.61093   2.63386   2.64041   2.65874   2.66316
 Alpha virt. eigenvalues --    2.67818   2.69651   2.70458   2.73000   2.73886
 Alpha virt. eigenvalues --    2.75727   2.77416   2.78241   2.82182   2.83712
 Alpha virt. eigenvalues --    2.85553   2.86890   2.91937   2.92152   2.93309
 Alpha virt. eigenvalues --    2.97247   2.98884   3.05674   3.07844   3.12123
 Alpha virt. eigenvalues --    3.16597   3.21084   3.27791   3.35179   3.42157
 Alpha virt. eigenvalues --    3.46591   3.54249   3.55898   3.57250   3.63727
 Alpha virt. eigenvalues --    3.76167   3.93355   4.19742   4.52966   5.28904
          Condensed to atoms (all electrons):
               1          2          3          4          5          6
     1  C   17.947114  -2.845554  -0.101878   0.269320  -2.580554  -0.210459
     2  C   -2.845554  15.177601  -1.881721   1.344856  -2.087604  -3.182841
     3  C   -0.101878  -1.881721   8.479230  -1.938242   0.891053   0.594746
     4  C    0.269320   1.344856  -1.938242   7.709291  -1.929425  -0.542961
     5  C   -2.580554  -2.087604   0.891053  -1.929425  14.693521   0.425917
     6  C   -0.210459  -3.182841   0.594746  -0.542961   0.425917  10.398588
     7  C   -0.072724   1.522199  -0.384174   0.280548  -1.576470  -1.268762
     8  C   -0.066316  -0.459324  -0.642399   0.217527   0.427938  -0.815572
     9  O    0.085711   0.052638  -0.032330   0.067413  -0.120339  -0.328766
    10  C   -1.698140  -0.275964  -0.148273   0.021283  -0.373439   0.094403
    11  C   -1.456442  -0.025891   0.009669  -0.089751  -0.389841   0.108369
    12  H    0.112112   0.336846  -0.582847   0.228733  -0.257972   0.099893
    13  H   -0.115819  -0.111145  -0.609922   0.225466   0.013711  -0.033406
    14  H    0.195044  -0.294684   0.534970  -0.639334  -0.462403   0.186499
    15  H   -0.174899  -0.198827   0.324746  -0.514016   0.616055  -0.067950
    16  H   -0.336161   0.132265   0.017900  -0.111808   0.649047  -0.057517
    17  H    0.400713  -0.398346   0.042410   0.145382  -0.671393   0.314634
    18  H   -0.188776   0.153285   0.074257   0.296077  -2.534677   0.029140
    19  H   -0.030728   0.057450   0.145897   0.031395  -0.069445   0.211028
    20  H   -0.164757   0.226508  -0.042936  -0.054097   0.077705  -0.011467
    21  H    0.055793  -0.169254  -0.023359   0.017577   0.086722  -0.234701
    22  H    0.506101  -0.300210   0.022521  -0.166909  -0.110657   0.062442
    23  H   -0.211404  -0.226538   0.188575  -0.081379   0.096968   0.051007
    24  H   -0.175424   0.320751  -0.111445   0.156459  -0.134358  -0.070570
    25  H    0.810010  -0.414263   0.001973   0.053398  -0.130870  -0.130646
    26  H   -0.132835   0.155819  -0.096536   0.082837  -0.303245  -0.049961
    27  H   -0.237122   0.015954   0.112724  -0.088261   0.142079   0.226375
               7          8          9         10         11         12
     1  C   -0.072724  -0.066316   0.085711  -1.698140  -1.456442   0.112112
     2  C    1.522199  -0.459324   0.052638  -0.275964  -0.025891   0.336846
     3  C   -0.384174  -0.642399  -0.032330  -0.148273   0.009669  -0.582847
     4  C    0.280548   0.217527   0.067413   0.021283  -0.089751   0.228733
     5  C   -1.576470   0.427938  -0.120339  -0.373439  -0.389841  -0.257972
     6  C   -1.268762  -0.815572  -0.328766   0.094403   0.108369   0.099893
     7  C    7.178826   0.025223  -0.040982  -0.108357  -0.154184   0.049663
     8  C    0.025223   6.723777   0.047171  -0.150353  -0.139900  -0.227701
     9  O   -0.040982   0.047171   8.759689   0.032277  -0.040744  -0.004410
    10  C   -0.108357  -0.150353   0.032277   6.673622  -0.398552  -0.008852
    11  C   -0.154184  -0.139900  -0.040744  -0.398552   6.500784   0.039712
    12  H    0.049663  -0.227701  -0.004410  -0.008852   0.039712   3.268873
    13  H   -0.097612   0.073587   0.028019   0.090914   0.004311  -1.152345
    14  H    0.074682  -0.065367  -0.004366   0.105245  -0.031633   0.270006
    15  H   -0.026298   0.040367   0.002922  -0.133544   0.054214  -0.611115
    16  H   -0.284874   0.055368   0.034511   0.047165  -0.102733  -0.003140
    17  H   -0.244812  -0.051426   0.033076  -0.014305   0.079033   0.005937
    18  H    0.261832  -0.059632  -0.001335   0.108077   0.120383   0.019937
    19  H    0.013806  -0.088352  -0.028495   0.002629   0.024381   0.012351
    20  H   -0.017515  -0.021088   0.020211   0.007164  -0.001520  -0.007169
    21  H   -0.011380   0.160795   0.019343   0.035161  -0.014723  -0.092943
    22  H    0.001452   0.059452  -0.006713  -0.218753   0.172894  -0.007701
    23  H   -0.058878  -0.170294   0.004829   0.320288   0.012133  -0.024310
    24  H    0.085562  -0.002536   0.003372   0.101752  -0.214752   0.009755
    25  H   -0.102827   0.064258   0.061183   0.113459  -0.180194   0.000831
    26  H    0.216577   0.005447   0.000909  -0.019881   0.013160  -0.011028
    27  H   -0.136454  -0.199917  -0.023388  -0.034515   0.258313   0.015637
              13         14         15         16         17         18
     1  C   -0.115819   0.195044  -0.174899  -0.336161   0.400713  -0.188776
     2  C   -0.111145  -0.294684  -0.198827   0.132265  -0.398346   0.153285
     3  C   -0.609922   0.534970   0.324746   0.017900   0.042410   0.074257
     4  C    0.225466  -0.639334  -0.514016  -0.111808   0.145382   0.296077
     5  C    0.013711  -0.462403   0.616055   0.649047  -0.671393  -2.534677
     6  C   -0.033406   0.186499  -0.067950  -0.057517   0.314634   0.029140
     7  C   -0.097612   0.074682  -0.026298  -0.284874  -0.244812   0.261832
     8  C    0.073587  -0.065367   0.040367   0.055368  -0.051426  -0.059632
     9  O    0.028019  -0.004366   0.002922   0.034511   0.033076  -0.001335
    10  C    0.090914   0.105245  -0.133544   0.047165  -0.014305   0.108077
    11  C    0.004311  -0.031633   0.054214  -0.102733   0.079033   0.120383
    12  H   -1.152345   0.270006  -0.611115  -0.003140   0.005937   0.019937
    13  H    3.202211  -0.387306   0.282495   0.010645  -0.008831  -0.005772
    14  H   -0.387306   2.986271  -1.093192   0.041923  -0.067886   0.086038
    15  H    0.282495  -1.093192   3.057038  -0.024806   0.062074  -0.159279
    16  H    0.010645   0.041923  -0.024806   2.210225  -0.765044  -0.130086
    17  H   -0.008831  -0.067886   0.062074  -0.765044   2.406617   0.061894
    18  H   -0.005772   0.086038  -0.159279  -0.130086   0.061894   3.627703
    19  H   -0.031867   0.002502  -0.003595  -0.001599  -0.003398   0.001139
    20  H    0.005360  -0.000777  -0.003559   0.004362  -0.003955  -0.001349
    21  H    0.062297  -0.009650   0.017099  -0.000716   0.001826  -0.006715
    22  H    0.019403   0.015328  -0.025210   0.009113  -0.004910  -0.002863
    23  H    0.020170  -0.010678   0.025090  -0.010889   0.004921   0.021170
    24  H   -0.007239   0.022696  -0.020059   0.012913  -0.002996   0.034623
    25  H    0.002739  -0.002919   0.009412  -0.073239   0.027374   0.006362
    26  H    0.004478  -0.005038   0.015606  -0.020337   0.026192   0.029538
    27  H   -0.001368   0.004591  -0.013910   0.028111  -0.013434   0.015813
              19         20         21         22         23         24
     1  C   -0.030728  -0.164757   0.055793   0.506101  -0.211404  -0.175424
     2  C    0.057450   0.226508  -0.169254  -0.300210  -0.226538   0.320751
     3  C    0.145897  -0.042936  -0.023359   0.022521   0.188575  -0.111445
     4  C    0.031395  -0.054097   0.017577  -0.166909  -0.081379   0.156459
     5  C   -0.069445   0.077705   0.086722  -0.110657   0.096968  -0.134358
     6  C    0.211028  -0.011467  -0.234701   0.062442   0.051007  -0.070570
     7  C    0.013806  -0.017515  -0.011380   0.001452  -0.058878   0.085562
     8  C   -0.088352  -0.021088   0.160795   0.059452  -0.170294  -0.002536
     9  O   -0.028495   0.020211   0.019343  -0.006713   0.004829   0.003372
    10  C    0.002629   0.007164   0.035161  -0.218753   0.320288   0.101752
    11  C    0.024381  -0.001520  -0.014723   0.172894   0.012133  -0.214752
    12  H    0.012351  -0.007169  -0.092943  -0.007701  -0.024310   0.009755
    13  H   -0.031867   0.005360   0.062297   0.019403   0.020170  -0.007239
    14  H    0.002502  -0.000777  -0.009650   0.015328  -0.010678   0.022696
    15  H   -0.003595  -0.003559   0.017099  -0.025210   0.025090  -0.020059
    16  H   -0.001599   0.004362  -0.000716   0.009113  -0.010889   0.012913
    17  H   -0.003398  -0.003955   0.001826  -0.004910   0.004921  -0.002996
    18  H    0.001139  -0.001349  -0.006715  -0.002863   0.021170   0.034623
    19  H    1.675088  -0.383381  -0.479574   0.005304   0.006945  -0.007374
    20  H   -0.383381   1.790230  -0.415380   0.026479  -0.021312  -0.002567
    21  H   -0.479574  -0.415380   2.107302  -0.048809   0.048858   0.023432
    22  H    0.005304   0.026479  -0.048809   2.466223  -0.605771  -0.529411
    23  H    0.006945  -0.021312   0.048858  -0.605771   2.281032  -0.481828
    24  H   -0.007374  -0.002567   0.023432  -0.529411  -0.481828   2.119117
    25  H    0.012500  -0.069550   0.026831  -0.045209   0.054837   0.000904
    26  H   -0.007596   0.023838   0.005143   0.031484   0.008853  -0.007387
    27  H    0.002957   0.049853  -0.033046   0.042962  -0.073189   0.020684
              25         26         27
     1  C    0.810010  -0.132835  -0.237122
     2  C   -0.414263   0.155819   0.015954
     3  C    0.001973  -0.096536   0.112724
     4  C    0.053398   0.082837  -0.088261
     5  C   -0.130870  -0.303245   0.142079
     6  C   -0.130646  -0.049961   0.226375
     7  C   -0.102827   0.216577  -0.136454
     8  C    0.064258   0.005447  -0.199917
     9  O    0.061183   0.000909  -0.023388
    10  C    0.113459  -0.019881  -0.034515
    11  C   -0.180194   0.013160   0.258313
    12  H    0.000831  -0.011028   0.015637
    13  H    0.002739   0.004478  -0.001368
    14  H   -0.002919  -0.005038   0.004591
    15  H    0.009412   0.015606  -0.013910
    16  H   -0.073239  -0.020337   0.028111
    17  H    0.027374   0.026192  -0.013434
    18  H    0.006362   0.029538   0.015813
    19  H    0.012500  -0.007596   0.002957
    20  H   -0.069550   0.023838   0.049853
    21  H    0.026831   0.005143  -0.033046
    22  H   -0.045209   0.031484   0.042962
    23  H    0.054837   0.008853  -0.073189
    24  H    0.000904  -0.007387   0.020684
    25  H    2.325620  -0.559645  -0.573749
    26  H   -0.559645   2.269719  -0.495784
    27  H   -0.573749  -0.495784   2.191947
 Mulliken charges:
               1
     1  C   -3.581924
     2  C   -0.624006
     3  C    1.155391
     4  C    1.008622
     5  C    1.611979
     6  C    0.202536
     7  C    0.875933
     8  C    1.259267
     9  O   -0.621405
    10  C    1.829490
    11  C    1.843502
    12  H   -0.478751
    13  H   -0.483176
    14  H   -0.450563
    15  H   -0.436858
    16  H   -0.330599
    17  H   -0.361348
    18  H   -0.856782
    19  H   -0.069971
    20  H   -0.009330
    21  H   -0.127929
    22  H   -0.368034
    23  H   -0.169204
    24  H   -0.144073
    25  H   -0.288579
    26  H   -0.180327
    27  H   -0.203862
 Sum of Mulliken charges =  -0.00000
 Mulliken charges with hydrogens summed into heavy atoms:
               1
     1  C   -3.581924
     2  C   -0.624006
     3  C    0.193464
     4  C    0.121201
     5  C    0.755197
     6  C    0.202536
     7  C    0.183987
     8  C    1.052038
     9  O   -0.621405
    10  C    1.148179
    11  C    1.170734
 Electronic spatial extent (au):  <R**2>=           1475.4366
 Charge=              0.0000 electrons
 Dipole moment (field-independent basis, Debye):
    X=              3.0994    Y=              0.9238    Z=             -0.1363  Tot=              3.2370
 Quadrupole moment (field-independent basis, Debye-Ang):
   XX=            -78.6708   YY=            -67.3421   ZZ=            -66.8955
   XY=             -2.4179   XZ=              1.1780   YZ=              0.3744
 Traceless Quadrupole moment (field-independent basis, Debye-Ang):
   XX=             -7.7013   YY=              3.6273   ZZ=              4.0740
   XY=             -2.4179   XZ=              1.1780   YZ=              0.3744
 Octapole moment (field-independent basis, Debye-Ang**2):
  XXX=             25.0446  YYY=              0.3583  ZZZ=              2.7137  XYY=             -4.1521
  XXY=              6.6910  XXZ=             -3.8722  XZZ=             -2.9071  YZZ=              0.7880
  YYZ=              0.7932  XYZ=              0.1053
 Hexadecapole moment (field-independent basis, Debye-Ang**3):
 XXXX=           -898.0301 YYYY=           -654.1828 ZZZZ=           -561.4634 XXXY=             -6.1293
 XXXZ=             16.0028 YYYX=             -6.9395 YYYZ=             -1.9405 ZZZX=             -4.7352
 ZZZY=              4.5189 XXYY=           -241.2040 XXZZ=           -220.0306 YYZZ=           -207.3956
 XXYZ=              1.8626 YYXZ=             -1.2892 ZZXY=              2.4120
 N-N= 6.881944666599D+02 E-N=-2.456863028691D+03  KE= 4.621047712445D+02
 No NMR shielding tensors so no spin-rotation constants.
 Leave Link  601 at Fri Jul 16 22:02:57 2021, MaxMem=  5637144576 cpu:               4.1 elap:               0.7
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l716.exe)
 Electric field and nuclear coordinate derivatives read from checkpoint file.
 Rotating derivatives to standard orientation.
 Dipole        = 1.19406424D+00 3.61083692D-01-5.72722282D-02
 Polarizability= 1.14673425D+02 7.41876557D-01 1.11152414D+02
                -7.58282032D-02 1.27064056D+00 1.07423950D+02
 Translational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 2     -0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 3      0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 4     -0.0000    0.0000        0.0000    0.0000        0.0000    0.0000
 5     -0.0000    0.0000        0.0000    0.0000        0.0000    0.0000
 6     -0.0000    0.0000        0.0000    0.0000        0.0000    0.0000
 Translational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000        0.1334    0.1327        0.5023    0.5010
 2     -0.1334   -0.1327       -0.7696   -0.7687       -2.3543   -2.3546
 3     -0.5023   -0.5010        4.2515    4.2513        0.7722    0.7687
 4      0.7696    0.7687        0.0000    0.0000       -0.5020   -0.5010
 5     -1.8972   -1.8967        0.5020    0.5010        0.1316    0.1327
 6     -0.7722   -0.7687       -0.1316   -0.1327       -0.0000    0.0000
 Translational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000       -0.3982   -0.3982        1.5030    1.5030
 2      2.3062    2.3062        0.0000    0.0000        1.5030    1.5030
 3      2.3062    2.3062       -0.3982   -0.3982        0.0000    0.0000
 4     -0.3982   -0.3982       -2.3062   -2.3062       -7.0638   -7.0638
 5     -1.5030   -1.5030       12.7539   12.7539        2.3062    2.3062
 6     -5.6901   -5.6901        1.5030    1.5030        0.3982    0.3982
 Rotational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0157    0.0000       -0.5269   -0.5309       -2.0273   -2.0041
 2      0.5394    0.5309        3.0510    3.0749        9.4093    9.4184
 3      2.0117    2.0041      -17.0513  -17.0052       -3.0384   -3.0749
 4     -3.0497   -3.0749        0.0280    0.0000        1.9886    2.0041
 5      7.5631    7.5868       -1.9783   -2.0041       -0.5723   -0.5309
 6      3.0677    3.0749        0.5766    0.5309        0.0145    0.0000
 Rotational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0782    0.0000        7.0144    7.0114        2.3202    2.2895
 2     -6.9866   -7.0114        4.1032    4.0609        9.3316    9.3565
 3     -2.3744   -2.2895       10.5121   10.4281       -3.8534   -4.0609
 4     -4.1517   -4.0609       -0.0332    0.0000       -2.3585   -2.2895
 5    -19.9022  -19.7846        2.2459    2.2895        6.9827    7.0114
 6      4.0628    4.0609       -6.9138   -7.0114        0.0182    0.0000
 Rotational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -6.9341   -6.9928       13.1375   13.0308       23.0276   22.9709
 2     -9.8041   -9.8090       20.7557   20.7373       22.9942   22.9709
 3     -9.8777   -9.8090       13.0210   13.0308       20.2677   20.3263
 4     -7.7061   -7.7065        2.9168    2.8162       13.6160   13.6408
 5     -2.7383   -2.6447       14.5803   14.5509       -2.6512   -2.8162
 6    -28.3885  -28.1917        2.5980    2.6447        7.6746    7.7065
 Full mass-weighted force constant matrix:
 Low frequencies ---  -15.6774   -6.3789   -0.0009   -0.0004   -0.0003    2.5755
 Low frequencies ---  107.8644  168.8419  183.4749
 Diagonal vibrational polarizability:
        4.4992302       6.3154133       7.5207719
 Harmonic frequencies (cm**-1), IR intensities (KM/Mole), Raman scattering
 activities (A**4/AMU), depolarization ratios for plane and unpolarized
 incident light, reduced masses (AMU), force constants (mDyne/A),
 Raman invariants Alpha2 = alpha**2, Beta2 = beta(alpha)**2 (A**4/AMU)
 ROA invariants AlphaG = alphaG', Gamma2 = beta(G')**2, Delta2 = beta(A)**2, (10**4 A**5/AMU)
 Far-From-Resonance Raman intensities (K), ROA intensites (10**4 K), CID=(ROA/Raman)*10**4
    Raman1;ROA1;CID1 =ICPu/SCPu(180), Raman2;ROA2;CID2 =ICPd/SCPd(90)
    Raman3;ROA3;CID3 =DCPI(180) RC180 = degree of circularity
 and normal coordinates:
 Incident light (cm**-1):   18796.99
                      1                      2                      3
                      A                      A                      A
 Frequencies --    107.8534               168.8412               183.4743
 Red. masses --      4.5339                 1.1763                 1.1199
 Frc consts  --      0.0311                 0.0198                 0.0222
 IR Inten    --      3.8144                 0.1064                 0.0775
 RamAct Fr= 1--      0.6949                 0.1425                 0.0687
  Dep-P Fr= 1--      0.7496                 0.7140                 0.7495
  Dep-U Fr= 1--      0.8569                 0.8332                 0.8568
 Alpha2 Fr= 1--      0.0000                 0.0001                 0.0000
 Beta2  Fr= 1--      0.0992                 0.0198                 0.0098
 AlphaG Fr= 1--      0.0002                -0.0008                -0.0002
 Gamma2 Fr= 1--      0.1386                -0.0397                 0.0868
 Delta2 Fr= 1--     -0.0407                 0.0203                 0.0012
 Raman1 Fr= 1--       2.780                  0.570                  0.275
 ROA1   Fr= 1--      12.008                 -3.164                  8.373
 CID1   Fr= 1--       4.320                 -5.552                 30.468
 Raman2 Fr= 1--       1.191                  0.237                  0.118
 ROA2   Fr= 1--       3.653                 -1.116                  2.074
 CID2   Fr= 1--       3.067                 -4.700                 17.616
 Raman3 Fr= 1--       2.382                  0.475                  0.235
 ROA3   Fr= 1--      12.008                 -3.164                  8.373
 CID3   Fr= 1--       5.042                 -6.664                 35.558
 RC180  Fr= 1--       0.714                  0.666                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.04   0.01  -0.00     0.00  -0.01   0.01    -0.00  -0.00   0.01
     2   6    -0.01   0.05  -0.06    -0.01  -0.01   0.02     0.00  -0.00   0.00
     3   6     0.03   0.08  -0.03    -0.03   0.02   0.03    -0.03   0.02   0.02
     4   6     0.13   0.02  -0.02     0.04  -0.02   0.02     0.02   0.00   0.01
     5   6     0.01   0.03  -0.03    -0.01  -0.01   0.02     0.00  -0.00   0.00
     6   6     0.01  -0.03   0.02    -0.02  -0.01  -0.00    -0.00  -0.01  -0.00
     7   6    -0.03   0.09  -0.12    -0.02   0.00  -0.01    -0.00  -0.00  -0.01
     8   6     0.01   0.08  -0.13     0.02  -0.00  -0.01     0.03   0.00  -0.03
     9   8     0.09  -0.25   0.28    -0.03   0.02  -0.05    -0.01   0.00  -0.02
    10   6    -0.04  -0.07   0.06    -0.01   0.01  -0.03    -0.02  -0.05  -0.01
    11   6    -0.15   0.04   0.01     0.05   0.00   0.02     0.00   0.04   0.03
    12   1    -0.03   0.06  -0.07    -0.10   0.02  -0.03    -0.07   0.03  -0.02
    13   1     0.02   0.16   0.02    -0.06   0.05   0.10    -0.05   0.05   0.06
    14   1     0.25   0.09  -0.06     0.10   0.02   0.00     0.06   0.03   0.01
    15   1     0.17  -0.11   0.02     0.06  -0.10   0.03     0.03  -0.05   0.01
    16   1    -0.12   0.25  -0.10    -0.05   0.03  -0.01    -0.01   0.02  -0.01
    17   1    -0.00   0.06  -0.30    -0.01   0.00  -0.05    -0.00  -0.01  -0.03
    18   1    -0.02  -0.00   0.02    -0.02  -0.02   0.04    -0.00  -0.01   0.01
    19   1     0.06   0.12  -0.22     0.09   0.01  -0.10    -0.27  -0.11   0.42
    20   1    -0.09   0.05  -0.18    -0.08  -0.00  -0.02     0.58  -0.12  -0.03
    21   1     0.06   0.08  -0.07     0.08  -0.02   0.08    -0.20   0.24  -0.47
    22   1    -0.02  -0.20  -0.01    -0.20  -0.32  -0.23    -0.04  -0.10  -0.04
    23   1    -0.04  -0.10   0.20     0.16  -0.03   0.35    -0.04  -0.06   0.05
    24   1    -0.04   0.01   0.03     0.01   0.39  -0.23     0.01  -0.02  -0.05
    25   1    -0.13   0.20   0.03     0.16   0.25   0.22     0.00   0.05   0.03
    26   1    -0.08  -0.07  -0.01     0.29  -0.19  -0.13    -0.00   0.08   0.02
    27   1    -0.32   0.00   0.01    -0.25  -0.05  -0.04     0.02   0.03   0.08
                      4                      5                      6
                      A                      A                      A
 Frequencies --    217.3103               224.8310               241.8621
 Red. masses --      1.9044                 1.1543                 2.5418
 Frc consts  --      0.0530                 0.0344                 0.0876
 IR Inten    --      0.2196                 0.3175                 0.7529
 RamAct Fr= 1--      0.2789                 0.1089                 0.5949
  Dep-P Fr= 1--      0.7499                 0.6932                 0.6065
  Dep-U Fr= 1--      0.8571                 0.8188                 0.7551
 Alpha2 Fr= 1--      0.0000                 0.0001                 0.0016
 Beta2  Fr= 1--      0.0398                 0.0149                 0.0749
 AlphaG Fr= 1--     -0.0000                 0.0016                 0.0011
 Gamma2 Fr= 1--      0.0572                -0.0233                 0.1326
 Delta2 Fr= 1--     -0.0274                 0.0135                 0.0579
 Raman1 Fr= 1--       1.115                  0.435                  2.380
 ROA1   Fr= 1--       4.617                 -1.800                 14.586
 CID1   Fr= 1--       4.139                 -4.135                  6.129
 Raman2 Fr= 1--       0.478                  0.178                  0.898
 ROA2   Fr= 1--       1.593                 -0.666                  2.720
 CID2   Fr= 1--       3.333                 -3.738                  3.028
 Raman3 Fr= 1--       0.956                  0.357                  1.797
 ROA3   Fr= 1--       4.617                 -1.800                 14.586
 CID3   Fr= 1--       4.829                 -5.049                  8.117
 RC180  Fr= 1--       0.714                  0.638                  0.510
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.00  -0.01    -0.00  -0.02  -0.01    -0.01   0.01  -0.01
     2   6     0.01   0.00  -0.02    -0.00  -0.01  -0.01     0.00   0.01   0.01
     3   6     0.05  -0.04  -0.04    -0.05   0.01  -0.00    -0.10   0.02   0.00
     4   6    -0.01  -0.02  -0.02     0.01  -0.02  -0.01    -0.03   0.01  -0.03
     5   6    -0.01  -0.00  -0.01     0.02  -0.02  -0.02     0.02   0.02  -0.02
     6   6     0.01   0.02   0.00     0.01  -0.00   0.01     0.00   0.02   0.03
     7   6     0.01   0.02  -0.00     0.03  -0.02   0.02     0.04   0.03   0.01
     8   6    -0.09  -0.01   0.05     0.01  -0.00  -0.04     0.25  -0.05   0.06
     9   8     0.02   0.01   0.04    -0.00   0.03   0.01    -0.02   0.09   0.04
    10   6     0.08   0.14   0.08     0.02   0.02   0.03    -0.02  -0.03   0.00
    11   6    -0.06  -0.12  -0.09    -0.04   0.01   0.00    -0.14  -0.09  -0.09
    12   1     0.11  -0.06   0.02    -0.10   0.02  -0.06    -0.17   0.05  -0.07
    13   1     0.08  -0.07  -0.11    -0.08   0.03   0.06    -0.15   0.03   0.10
    14   1    -0.06  -0.04  -0.03     0.04   0.01  -0.00    -0.01   0.02  -0.00
    15   1    -0.02   0.03  -0.01     0.01  -0.06  -0.03    -0.05  -0.03  -0.08
    16   1     0.01   0.02  -0.00     0.08  -0.06   0.02     0.06   0.04   0.01
    17   1     0.01   0.02  -0.00     0.02  -0.02   0.07     0.03   0.02   0.01
    18   1     0.01   0.00  -0.03     0.04  -0.03  -0.03     0.04   0.03  -0.05
    19   1    -0.27  -0.03   0.31     0.05   0.01  -0.09     0.31  -0.28  -0.01
    20   1     0.15  -0.01   0.09    -0.04  -0.01  -0.05     0.35  -0.04   0.09
    21   1    -0.25   0.01  -0.19     0.04  -0.00   0.01     0.37   0.08   0.15
    22   1     0.04   0.05   0.03    -0.09  -0.22  -0.12     0.02   0.01   0.03
    23   1     0.29   0.15   0.23     0.20  -0.00   0.33    -0.07  -0.03  -0.05
    24   1    -0.03   0.39   0.09    -0.01   0.35  -0.09    -0.01  -0.11   0.03
    25   1    -0.03  -0.03  -0.05    -0.18  -0.30  -0.25    -0.14  -0.00  -0.10
    26   1     0.03  -0.33  -0.08    -0.35   0.29   0.18    -0.10  -0.30  -0.03
    27   1    -0.23  -0.13  -0.24     0.36   0.07   0.11    -0.30  -0.10  -0.21
                      7                      8                      9
                      A                      A                      A
 Frequencies --    262.3832               290.0213               300.8236
 Red. masses --      2.2777                 1.9455                 2.8745
 Frc consts  --      0.0924                 0.0964                 0.1533
 IR Inten    --      0.6152                 0.3555                 1.8442
 RamAct Fr= 1--      0.8570                 0.3943                 0.6732
  Dep-P Fr= 1--      0.6114                 0.4059                 0.6081
  Dep-U Fr= 1--      0.7588                 0.5775                 0.7563
 Alpha2 Fr= 1--      0.0022                 0.0029                 0.0018
 Beta2  Fr= 1--      0.1084                 0.0380                 0.0849
 AlphaG Fr= 1--      0.0034                 0.0112                -0.0037
 Gamma2 Fr= 1--     -0.0778                 0.0208                 0.1632
 Delta2 Fr= 1--     -0.0735                -0.0036                 0.0923
 Raman1 Fr= 1--       3.428                  1.577                  2.693
 ROA1   Fr= 1--      -9.820                  1.882                 18.624
 CID1   Fr= 1--      -2.865                  1.193                  6.916
 Raman2 Fr= 1--       1.301                  0.455                  1.018
 ROA2   Fr= 1--      -1.279                  0.529                  3.179
 CID2   Fr= 1--      -0.984                  1.161                  3.122
 Raman3 Fr= 1--       2.601                  0.911                  2.037
 ROA3   Fr= 1--      -9.820                  1.882                 18.624
 CID3   Fr= 1--      -3.775                  2.067                  9.145
 RC180  Fr= 1--       0.518                  0.155                  0.513
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.02   0.01  -0.01    -0.01   0.02  -0.02    -0.06  -0.02   0.02
     2   6    -0.01   0.03   0.00     0.02   0.05  -0.04    -0.05  -0.02  -0.00
     3   6     0.03   0.06   0.02     0.11   0.00  -0.05     0.18  -0.10  -0.02
     4   6     0.13   0.01   0.06    -0.10   0.08   0.02     0.03  -0.04   0.02
     5   6    -0.02   0.00   0.05     0.00   0.02   0.01    -0.04  -0.02   0.02
     6   6    -0.02   0.01  -0.04     0.03   0.02  -0.02    -0.08   0.04   0.00
     7   6    -0.06   0.04  -0.06     0.02  -0.04   0.08    -0.04   0.03  -0.02
     8   6    -0.01  -0.04   0.19     0.01   0.01   0.07     0.11  -0.01  -0.10
     9   8     0.00  -0.07  -0.03     0.05  -0.04  -0.01    -0.10   0.10   0.15
    10   6    -0.06   0.03  -0.12    -0.06  -0.11  -0.06    -0.08   0.06  -0.08
    11   6     0.02  -0.07  -0.06    -0.08   0.04  -0.01     0.08  -0.03   0.01
    12   1    -0.02   0.06  -0.03     0.28   0.02   0.09     0.37  -0.19   0.19
    13   1     0.04   0.16   0.07     0.18  -0.09  -0.23     0.32  -0.13  -0.29
    14   1     0.25   0.08   0.01    -0.27  -0.03   0.07    -0.06  -0.09  -0.03
    15   1     0.18  -0.12   0.13    -0.14   0.28   0.03     0.03   0.06   0.09
    16   1    -0.15   0.08  -0.06     0.08  -0.16   0.07    -0.08   0.02  -0.02
    17   1    -0.02   0.05  -0.14     0.00  -0.02   0.21    -0.01   0.04  -0.03
    18   1    -0.06  -0.03   0.12     0.02   0.02  -0.01    -0.04  -0.04   0.04
    19   1    -0.04  -0.16   0.25    -0.01  -0.06   0.11     0.13  -0.10  -0.12
    20   1     0.05   0.11   0.33     0.04   0.09   0.15     0.23  -0.12  -0.17
    21   1    -0.03  -0.14   0.21    -0.01  -0.05   0.08     0.17   0.18  -0.13
    22   1    -0.14   0.02  -0.14    -0.17  -0.38  -0.22    -0.17   0.03  -0.10
    23   1    -0.07   0.03  -0.13    -0.06  -0.16   0.23    -0.01   0.06  -0.05
    24   1     0.00   0.03  -0.19     0.02   0.10  -0.24    -0.06   0.14  -0.14
    25   1    -0.07  -0.31  -0.20    -0.08   0.11  -0.02     0.08  -0.17   0.03
    26   1    -0.17   0.07   0.06    -0.07   0.01  -0.00     0.04   0.08  -0.00
    27   1     0.29  -0.01  -0.08    -0.14   0.03   0.02     0.23  -0.00   0.02
                     10                     11                     12
                      A                      A                      A
 Frequencies --    384.7229               395.1090               415.9510
 Red. masses --      2.4671                 2.4238                 2.1458
 Frc consts  --      0.2151                 0.2229                 0.2187
 IR Inten    --      0.7434                 0.1689                 1.2041
 RamAct Fr= 1--      0.4089                 1.5087                 0.4310
  Dep-P Fr= 1--      0.4894                 0.2118                 0.6188
  Dep-U Fr= 1--      0.6572                 0.3496                 0.7645
 Alpha2 Fr= 1--      0.0021                 0.0199                 0.0010
 Beta2  Fr= 1--      0.0448                 0.0879                 0.0549
 AlphaG Fr= 1--     -0.0102                -0.0108                -0.0053
 Gamma2 Fr= 1--     -0.1575                -0.1897                 0.2396
 Delta2 Fr= 1--     -0.0328                -0.1692                 0.1238
 Raman1 Fr= 1--       1.636                  6.035                  1.724
 ROA1   Fr= 1--     -16.174                -23.628                 26.962
 CID1   Fr= 1--      -9.889                 -3.915                 15.640
 Raman2 Fr= 1--       0.537                  1.055                  0.659
 ROA2   Fr= 1--      -3.519                 -3.200                  4.760
 CID2   Fr= 1--      -6.547                 -3.033                  7.223
 Raman3 Fr= 1--       1.075                  2.110                  1.318
 ROA3   Fr= 1--     -16.174                -23.628                 26.962
 CID3   Fr= 1--     -15.048                -11.198                 20.458
 RC180  Fr= 1--       0.314                 -0.301                  0.529
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.04   0.03   0.10    -0.00   0.02  -0.01    -0.03   0.08   0.03
     2   6     0.06  -0.00   0.13    -0.02   0.05  -0.03    -0.02   0.06   0.03
     3   6    -0.02  -0.09   0.08    -0.02   0.06  -0.03     0.02  -0.05  -0.04
     4   6    -0.08  -0.01  -0.04    -0.05   0.06  -0.02     0.11  -0.07  -0.11
     5   6    -0.00   0.08   0.01    -0.04   0.04  -0.02    -0.04   0.08  -0.04
     6   6     0.05   0.02   0.04    -0.05   0.03  -0.03    -0.03   0.01   0.04
     7   6    -0.03   0.13  -0.04    -0.06   0.02  -0.05     0.00  -0.05   0.14
     8   6    -0.00   0.09  -0.04     0.01   0.03   0.03     0.02   0.08   0.01
     9   8     0.07  -0.03  -0.07    -0.04   0.00   0.03    -0.01  -0.06  -0.04
    10   6    -0.04  -0.04  -0.05     0.05  -0.16   0.15    -0.06   0.01   0.02
    11   6    -0.00  -0.13   0.01     0.18  -0.09  -0.06     0.01  -0.01  -0.02
    12   1    -0.01  -0.13   0.10     0.01   0.07  -0.01    -0.04  -0.16  -0.04
    13   1    -0.04  -0.21   0.06    -0.01   0.04  -0.06     0.02  -0.00  -0.03
    14   1    -0.17  -0.07  -0.06    -0.06   0.05  -0.01     0.29   0.02  -0.30
    15   1    -0.12   0.06  -0.10    -0.05   0.07  -0.02     0.20  -0.30   0.00
    16   1    -0.10   0.27  -0.02    -0.06  -0.01  -0.05     0.28  -0.30   0.13
    17   1    -0.02   0.09  -0.22    -0.05   0.03  -0.02    -0.12  -0.04   0.48
    18   1    -0.02   0.17  -0.04    -0.08   0.07  -0.02    -0.04   0.13  -0.08
    19   1     0.00   0.29  -0.06     0.01  -0.05   0.03     0.02   0.09  -0.00
    20   1    -0.06  -0.07  -0.20     0.04   0.08   0.08     0.03   0.04  -0.03
    21   1    -0.03   0.16  -0.12     0.02   0.01   0.06     0.03   0.15  -0.01
    22   1    -0.19  -0.13  -0.12     0.25  -0.34   0.08    -0.02  -0.01   0.02
    23   1    -0.12  -0.06   0.01    -0.04  -0.20   0.38    -0.14   0.00   0.03
    24   1     0.10  -0.02  -0.22    -0.02  -0.13   0.22    -0.04  -0.04   0.02
    25   1    -0.08  -0.30  -0.12     0.21  -0.31   0.04     0.04  -0.09   0.04
    26   1    -0.13  -0.19   0.17     0.19  -0.02  -0.11     0.05  -0.09  -0.03
    27   1     0.12  -0.08  -0.15     0.37  -0.02  -0.18     0.01   0.01  -0.15
                     13                     14                     15
                      A                      A                      A
 Frequencies --    476.4676               525.0170               560.6597
 Red. masses --      3.2728                 2.9420                 4.2152
 Frc consts  --      0.4378                 0.4778                 0.7807
 IR Inten    --      0.6315                 4.2454                 2.3808
 RamAct Fr= 1--      2.0570                 0.5510                 4.6750
  Dep-P Fr= 1--      0.6017                 0.4181                 0.2232
  Dep-U Fr= 1--      0.7513                 0.5897                 0.3650
 Alpha2 Fr= 1--      0.0056                 0.0038                 0.0597
 Beta2  Fr= 1--      0.2576                 0.0542                 0.2844
 AlphaG Fr= 1--     -0.0065                 0.0031                -0.0744
 Gamma2 Fr= 1--     -0.8480                 0.4870                -0.2673
 Delta2 Fr= 1--     -0.0355                 0.0911                 0.1921
 Raman1 Fr= 1--       8.228                  2.204                 18.700
 ROA1   Fr= 1--     -82.539                 49.668                -19.509
 CID1   Fr= 1--     -10.032                 22.535                 -1.043
 Raman2 Fr= 1--       3.091                  0.650                  3.413
 ROA2   Fr= 1--     -20.068                 10.959                 -7.951
 CID2   Fr= 1--      -6.493                 16.864                 -2.330
 Raman3 Fr= 1--       6.182                  1.300                  6.825
 ROA3   Fr= 1--     -82.539                 49.668                -19.509
 CID3   Fr= 1--     -13.352                 38.215                 -2.858
 RC180  Fr= 1--       0.503                  0.179                 -0.270
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.13   0.08  -0.08     0.03   0.08   0.09    -0.05   0.03  -0.08
     2   6     0.03  -0.02   0.07     0.12  -0.08  -0.05     0.03  -0.01  -0.08
     3   6     0.05  -0.04   0.08     0.02   0.04  -0.02    -0.05  -0.10  -0.06
     4   6     0.04   0.00   0.03     0.02   0.06  -0.02    -0.07  -0.19   0.12
     5   6    -0.05   0.05   0.02    -0.09   0.12   0.00    -0.14  -0.03   0.16
     6   6    -0.06  -0.10   0.12     0.10  -0.06  -0.07     0.13   0.12  -0.01
     7   6    -0.09  -0.06   0.02    -0.05  -0.12  -0.06    -0.10   0.11   0.13
     8   6    -0.02   0.01   0.01    -0.04  -0.12  -0.04     0.01  -0.06  -0.05
     9   8    -0.12   0.04   0.01     0.04   0.14   0.10     0.19   0.06   0.00
    10   6     0.19  -0.07  -0.07    -0.05   0.00   0.00    -0.03  -0.02   0.02
    11   6    -0.06   0.11  -0.16    -0.01  -0.04   0.05     0.03   0.09  -0.14
    12   1     0.12  -0.11   0.17    -0.09   0.17  -0.18    -0.06   0.02  -0.13
    13   1     0.10  -0.06  -0.03    -0.08   0.04   0.16    -0.09  -0.07   0.02
    14   1     0.11   0.04  -0.11     0.09   0.09  -0.13     0.14  -0.08  -0.07
    15   1     0.09  -0.11   0.11     0.07  -0.04   0.07     0.04  -0.40   0.29
    16   1    -0.10   0.15   0.05    -0.00  -0.33  -0.09    -0.35   0.14   0.11
    17   1    -0.16  -0.14  -0.16    -0.27  -0.21   0.10    -0.03   0.11  -0.05
    18   1    -0.14   0.10   0.07    -0.20   0.23   0.03    -0.03  -0.06   0.07
    19   1    -0.02   0.14   0.00    -0.09   0.05   0.03     0.02  -0.07  -0.07
    20   1    -0.09  -0.04  -0.06    -0.14  -0.07  -0.02     0.02  -0.06  -0.05
    21   1    -0.05  -0.01  -0.03    -0.15  -0.30  -0.10     0.02  -0.04  -0.04
    22   1     0.31  -0.19  -0.11    -0.17  -0.05  -0.04     0.13  -0.11   0.00
    23   1     0.04  -0.11   0.04    -0.21  -0.02  -0.01    -0.15  -0.04   0.10
    24   1     0.21  -0.13  -0.06     0.11  -0.08  -0.14    -0.06  -0.09   0.09
    25   1    -0.15   0.20  -0.36    -0.02  -0.11   0.04     0.06   0.10  -0.08
    26   1    -0.18   0.01   0.01    -0.02  -0.17   0.13     0.05   0.21  -0.22
    27   1    -0.16   0.09  -0.14    -0.02  -0.01  -0.11     0.07   0.09  -0.05
                     16                     17                     18
                      A                      A                      A
 Frequencies --    576.2037               619.5430               652.5346
 Red. masses --      3.6222                 2.6584                 3.7574
 Frc consts  --      0.7086                 0.6012                 0.9426
 IR Inten    --      0.8356                 0.9632                 2.1404
 RamAct Fr= 1--      2.1961                 1.8846                23.6088
  Dep-P Fr= 1--      0.5112                 0.5456                 0.0168
  Dep-U Fr= 1--      0.6765                 0.7060                 0.0330
 Alpha2 Fr= 1--      0.0103                 0.0074                 0.5044
 Beta2  Fr= 1--      0.2476                 0.2218                 0.1299
 AlphaG Fr= 1--     -0.0213                -0.0574                 0.2776
 Gamma2 Fr= 1--      0.3896                 0.0649                -0.2879
 Delta2 Fr= 1--     -0.4069                 0.1831                 0.0732
 Raman1 Fr= 1--       8.784                  7.538                 94.435
 ROA1   Fr= 1--      24.381                 12.088                -25.291
 CID1   Fr= 1--       2.776                  1.604                 -0.268
 Raman2 Fr= 1--       2.971                  2.661                  1.558
 ROA2   Fr= 1--      12.606                  0.092                 -7.495
 CID2   Fr= 1--       4.243                  0.035                 -4.810
 Raman3 Fr= 1--       5.943                  5.322                  3.117
 ROA3   Fr= 1--      24.381                 12.088                -25.291
 CID3   Fr= 1--       4.103                  2.271                 -8.115
 RC180  Fr= 1--       0.353                  0.412                 -0.934
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.12  -0.06   0.06    -0.03  -0.06  -0.01    -0.04   0.05  -0.02
     2   6     0.05   0.10  -0.05     0.04   0.07  -0.05     0.03   0.04   0.07
     3   6    -0.04  -0.02  -0.11     0.03   0.05  -0.13    -0.03  -0.08   0.11
     4   6    -0.06  -0.12  -0.02    -0.01  -0.01  -0.06    -0.01  -0.08   0.04
     5   6    -0.06  -0.08   0.04    -0.05  -0.06  -0.03     0.06  -0.09   0.01
     6   6    -0.06   0.12  -0.13     0.09  -0.14   0.18     0.06  -0.04  -0.11
     7   6    -0.10  -0.04  -0.01    -0.04  -0.08   0.04     0.04  -0.19  -0.18
     8   6     0.04   0.18   0.05     0.02   0.12   0.04     0.04   0.21   0.09
     9   8    -0.02   0.00   0.07     0.01   0.08  -0.03     0.03   0.05   0.05
    10   6     0.19  -0.03  -0.09    -0.05   0.01   0.01    -0.13   0.03   0.06
    11   6    -0.02  -0.06   0.14     0.01  -0.05   0.05     0.00   0.09  -0.13
    12   1    -0.12   0.03  -0.21     0.04   0.03  -0.11    -0.04  -0.15   0.14
    13   1    -0.12  -0.03   0.02     0.02   0.03  -0.13    -0.04  -0.13   0.10
    14   1    -0.01  -0.09  -0.02     0.02   0.01  -0.04    -0.10  -0.12   0.13
    15   1    -0.04  -0.14   0.05     0.02  -0.00   0.03    -0.07   0.01  -0.07
    16   1    -0.20  -0.28  -0.07    -0.12   0.50   0.13    -0.07  -0.34  -0.23
    17   1     0.02   0.07   0.16    -0.16  -0.29  -0.53     0.03  -0.18  -0.10
    18   1    -0.13   0.08  -0.01    -0.04  -0.05  -0.05    -0.01  -0.12   0.09
    19   1     0.02   0.14   0.08     0.01   0.08   0.07     0.02   0.34   0.11
    20   1     0.05   0.23   0.10     0.02   0.21   0.13    -0.02   0.18   0.05
    21   1     0.02   0.13   0.06     0.00   0.02   0.07    -0.01   0.20   0.04
    22   1     0.03   0.04  -0.09    -0.09   0.05   0.03    -0.04  -0.00   0.06
    23   1     0.19  -0.01  -0.19     0.01   0.02  -0.03    -0.13   0.02   0.12
    24   1     0.28  -0.05  -0.19    -0.07   0.04   0.02    -0.19   0.04   0.12
    25   1    -0.07   0.10   0.02     0.04  -0.04   0.12     0.03   0.03  -0.08
    26   1    -0.08  -0.07   0.20     0.04   0.06  -0.03     0.04   0.09  -0.17
    27   1    -0.13  -0.10   0.26     0.05  -0.05   0.13     0.04   0.11  -0.18
                     19                     20                     21
                      A                      A                      A
 Frequencies --    714.3281               756.0539               836.2095
 Red. masses --      2.9996                 2.0838                 1.5196
 Frc consts  --      0.9018                 0.7018                 0.6261
 IR Inten    --      0.4383                 7.3510                 0.3252
 RamAct Fr= 1--      3.5909                 1.8429                 1.1600
  Dep-P Fr= 1--      0.4896                 0.6965                 0.1383
  Dep-U Fr= 1--      0.6573                 0.8211                 0.2430
 Alpha2 Fr= 1--      0.0186                 0.0017                 0.0185
 Beta2  Fr= 1--      0.3934                 0.2522                 0.0470
 AlphaG Fr= 1--      0.0303                 0.0079                 0.0642
 Gamma2 Fr= 1--      1.5059                 0.0088                -0.5729
 Delta2 Fr= 1--      0.5460                -0.0205                -0.1458
 Raman1 Fr= 1--      14.364                  7.372                  4.640
 ROA1   Fr= 1--     162.033                  0.195                -59.662
 CID1   Fr= 1--      11.281                  0.026                -12.858
 Raman2 Fr= 1--       4.721                  3.026                  0.564
 ROA2   Fr= 1--      31.773                  0.376                -12.582
 CID2   Fr= 1--       6.730                  0.124                -22.319
 Raman3 Fr= 1--       9.442                  6.053                  1.127
 ROA3   Fr= 1--     162.033                  0.195                -59.662
 CID3   Fr= 1--      17.161                  0.032                -52.916
 RC180  Fr= 1--       0.315                  0.642                 -0.514
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.08   0.18   0.12    -0.03  -0.07  -0.04     0.01   0.01   0.02
     2   6     0.03   0.03  -0.10     0.20  -0.05   0.03    -0.10   0.02   0.01
     3   6    -0.01  -0.02  -0.13     0.09  -0.02  -0.01     0.03  -0.04  -0.02
     4   6    -0.02  -0.11   0.04     0.03   0.02  -0.03     0.09   0.01  -0.06
     5   6     0.13  -0.03   0.10    -0.03  -0.05  -0.03     0.04   0.01   0.05
     6   6    -0.09  -0.05  -0.02    -0.07   0.02   0.02     0.03   0.03   0.01
     7   6     0.10  -0.01   0.04    -0.04   0.08   0.05    -0.08  -0.04   0.02
     8   6    -0.00  -0.03  -0.03     0.05   0.01   0.02    -0.04  -0.02  -0.00
     9   8    -0.12  -0.04  -0.00    -0.06  -0.02   0.02     0.04   0.01  -0.01
    10   6    -0.05   0.04   0.05    -0.05  -0.01   0.02     0.02  -0.01  -0.00
    11   6     0.03   0.05  -0.02    -0.00   0.02  -0.06     0.00   0.01  -0.01
    12   1    -0.07   0.08  -0.23    -0.24   0.15  -0.38    -0.30  -0.19  -0.22
    13   1    -0.04   0.07  -0.03    -0.14   0.01   0.45    -0.03   0.25   0.25
    14   1    -0.11  -0.16   0.17    -0.19  -0.11  -0.01    -0.35  -0.25   0.01
    15   1    -0.08   0.04  -0.03    -0.01   0.28   0.02    -0.03   0.48  -0.13
    16   1    -0.11   0.28   0.07     0.05   0.01   0.05    -0.19  -0.04   0.01
    17   1     0.28   0.03  -0.26     0.03   0.14   0.16    -0.15  -0.10  -0.05
    18   1     0.15   0.09  -0.00     0.03  -0.15  -0.01    -0.00  -0.02   0.12
    19   1    -0.04   0.02   0.03    -0.02   0.33   0.12     0.03  -0.21  -0.11
    20   1    -0.06   0.04   0.02    -0.12  -0.01  -0.03     0.09  -0.08  -0.04
    21   1    -0.08  -0.18  -0.06    -0.12  -0.19  -0.11     0.10   0.20   0.07
    22   1    -0.14  -0.08  -0.03    -0.07   0.03   0.03     0.01  -0.00  -0.00
    23   1    -0.35   0.00   0.09     0.01   0.00  -0.00     0.02  -0.01   0.01
    24   1     0.17  -0.11  -0.13    -0.09   0.03   0.05     0.02  -0.01  -0.00
    25   1    -0.02  -0.06  -0.10     0.02   0.05  -0.02    -0.01   0.00  -0.03
    26   1    -0.02  -0.15   0.13     0.02   0.11  -0.13    -0.01  -0.01   0.02
    27   1     0.02   0.10  -0.28     0.01   0.00   0.03    -0.00   0.02  -0.04
                     22                     23                     24
                      A                      A                      A
 Frequencies --    863.2119               873.5968               926.6827
 Red. masses --      2.6435                 2.1939                 2.5998
 Frc consts  --      1.1606                 0.9865                 1.3154
 IR Inten    --      1.9531                 0.4185                 1.1582
 RamAct Fr= 1--      3.1687                 6.0617                 3.9277
  Dep-P Fr= 1--      0.0837                 0.1942                 0.1447
  Dep-U Fr= 1--      0.1544                 0.3252                 0.2529
 Alpha2 Fr= 1--      0.0577                 0.0836                 0.0615
 Beta2  Fr= 1--      0.0815                 0.3285                 0.1655
 AlphaG Fr= 1--     -0.0004                -0.1630                -0.0035
 Gamma2 Fr= 1--     -0.2432                -0.3319                 1.6258
 Delta2 Fr= 1--     -0.2335                -0.1347                 0.1351
 Raman1 Fr= 1--      12.675                 24.247                 15.711
 ROA1   Fr= 1--     -30.818                -36.169                160.399
 CID1   Fr= 1--      -2.431                 -1.492                 10.210
 Raman2 Fr= 1--       0.979                  3.942                  1.987
 ROA2   Fr= 1--      -3.968                 -6.887                 37.939
 CID2   Fr= 1--      -4.055                 -1.747                 19.098
 Raman3 Fr= 1--       1.957                  7.885                  3.973
 ROA3   Fr= 1--     -30.818                -36.169                160.399
 CID3   Fr= 1--     -15.747                 -4.587                 40.371
 RC180  Fr= 1--      -0.691                 -0.350                 -0.494
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.04  -0.05  -0.05     0.02   0.00   0.01     0.05   0.01   0.05
     2   6     0.04   0.04  -0.12     0.03  -0.03   0.11     0.02   0.04  -0.07
     3   6    -0.03  -0.11   0.10    -0.07   0.02  -0.12     0.04   0.04   0.21
     4   6     0.01   0.06  -0.05     0.03   0.15  -0.10    -0.02   0.01  -0.12
     5   6     0.12   0.18   0.15     0.07  -0.09   0.08    -0.02  -0.16  -0.10
     6   6    -0.02  -0.05  -0.09    -0.01   0.05  -0.03    -0.01   0.08  -0.01
     7   6     0.01  -0.01   0.08    -0.07  -0.04   0.06    -0.08  -0.03   0.08
     8   6     0.02   0.03  -0.04     0.01  -0.04   0.04    -0.01  -0.01  -0.08
     9   8    -0.05  -0.00   0.02     0.01  -0.00   0.01     0.03   0.00   0.01
    10   6    -0.01  -0.02  -0.02    -0.03   0.01   0.02    -0.02   0.03   0.05
    11   6    -0.02  -0.05   0.01     0.01   0.01  -0.01     0.03   0.04  -0.01
    12   1    -0.03  -0.08   0.07     0.12  -0.06   0.08     0.06   0.06   0.22
    13   1    -0.07  -0.23   0.10    -0.05  -0.25  -0.33     0.04  -0.08   0.14
    14   1     0.03   0.05  -0.29     0.24   0.29  -0.01     0.05   0.06  -0.13
    15   1    -0.03  -0.10  -0.24     0.05  -0.09  -0.19    -0.02  -0.12  -0.20
    16   1    -0.30   0.07   0.06    -0.41  -0.08   0.01    -0.21   0.10   0.09
    17   1    -0.06  -0.10  -0.15     0.08   0.02  -0.06     0.07   0.01  -0.10
    18   1     0.20   0.08   0.15     0.13  -0.27   0.17     0.06  -0.22  -0.14
    19   1    -0.06  -0.06   0.08     0.03   0.23  -0.01    -0.06  -0.34   0.01
    20   1     0.01   0.29   0.19    -0.09  -0.27  -0.19     0.09   0.30   0.22
    21   1    -0.06  -0.24   0.00    -0.03   0.07  -0.08     0.01  -0.22   0.07
    22   1     0.05   0.06   0.03    -0.04   0.01   0.02    -0.19  -0.01   0.00
    23   1     0.19   0.00  -0.03    -0.03   0.01   0.01    -0.18   0.02  -0.02
    24   1    -0.15   0.09   0.08    -0.02   0.01   0.01     0.17  -0.06  -0.13
    25   1     0.04   0.04   0.12    -0.02   0.04  -0.09    -0.03  -0.00  -0.14
    26   1     0.03   0.17  -0.15    -0.02  -0.02   0.04    -0.02  -0.15   0.14
    27   1     0.05  -0.08   0.25    -0.02   0.01  -0.03    -0.03   0.06  -0.19
                     25                     26                     27
                      A                      A                      A
 Frequencies --    944.2818               947.7758               960.2831
 Red. masses --      1.7395                 2.1469                 1.6752
 Frc consts  --      0.9138                 1.1363                 0.9102
 IR Inten    --      2.2311                 1.8846                 1.4287
 RamAct Fr= 1--      2.2216                 1.7652                 3.8003
  Dep-P Fr= 1--      0.4855                 0.7122                 0.7463
  Dep-U Fr= 1--      0.6537                 0.8319                 0.8547
 Alpha2 Fr= 1--      0.0117                 0.0012                 0.0002
 Beta2  Fr= 1--      0.2420                 0.2448                 0.5414
 AlphaG Fr= 1--     -0.0097                 0.0104                 0.0049
 Gamma2 Fr= 1--      0.3729                 0.4944                -0.4150
 Delta2 Fr= 1--      0.7829                 0.6906                -1.1393
 Raman1 Fr= 1--       8.886                  7.061                 15.201
 ROA1   Fr= 1--      60.855                 69.560                -76.296
 CID1   Fr= 1--       6.848                  9.851                 -5.019
 Raman2 Fr= 1--       2.904                  2.937                  6.497
 ROA2   Fr= 1--       2.687                  6.341                 -0.845
 CID2   Fr= 1--       0.925                  2.159                 -0.130
 Raman3 Fr= 1--       5.809                  5.874                 12.993
 ROA3   Fr= 1--      60.855                 69.560                -76.296
 CID3   Fr= 1--      10.477                 11.842                 -5.872
 RC180  Fr= 1--       0.307                  0.664                  0.709
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03  -0.03  -0.00     0.05  -0.09   0.05    -0.03   0.07  -0.08
     2   6    -0.03  -0.02   0.05     0.00  -0.00   0.04     0.01  -0.01   0.02
     3   6     0.09   0.03   0.01     0.01   0.15   0.00     0.02   0.08   0.04
     4   6    -0.08   0.01  -0.03    -0.04  -0.15  -0.04    -0.02  -0.08  -0.03
     5   6    -0.05   0.04  -0.00     0.10   0.07   0.01     0.04  -0.01  -0.02
     6   6    -0.02   0.05  -0.08     0.01  -0.02   0.00     0.01  -0.01  -0.03
     7   6     0.11  -0.10   0.05    -0.09   0.03   0.01    -0.04   0.01   0.03
     8   6    -0.03  -0.01   0.04     0.00  -0.02   0.01     0.03  -0.02   0.01
     9   8    -0.00  -0.02   0.01    -0.01   0.00   0.00     0.00   0.01   0.01
    10   6    -0.04  -0.02  -0.01    -0.05  -0.05   0.05    -0.03   0.06  -0.09
    11   6     0.03   0.00  -0.01     0.03   0.02  -0.09     0.02  -0.05   0.09
    12   1    -0.08   0.14  -0.18     0.17   0.15   0.14     0.05   0.05   0.07
    13   1    -0.01   0.10   0.23     0.14   0.22  -0.18     0.08   0.18  -0.00
    14   1     0.05   0.06  -0.31    -0.04  -0.14   0.06    -0.08  -0.13   0.01
    15   1     0.05  -0.14   0.25    -0.11  -0.09  -0.20    -0.05  -0.01  -0.09
    16   1    -0.19   0.22   0.07    -0.15  -0.16  -0.03    -0.15  -0.05   0.01
    17   1     0.32  -0.06  -0.32    -0.24  -0.03   0.11    -0.08  -0.02  -0.01
    18   1    -0.08   0.23  -0.13     0.14   0.31  -0.21     0.21  -0.07  -0.14
    19   1     0.05  -0.02  -0.08     0.00   0.04   0.00    -0.01   0.16   0.05
    20   1     0.04  -0.19  -0.11    -0.03  -0.07  -0.04    -0.07  -0.06  -0.04
    21   1     0.07   0.24   0.03    -0.01  -0.01  -0.02    -0.06  -0.07  -0.06
    22   1     0.02   0.06   0.05    -0.33   0.17   0.13     0.56  -0.18  -0.12
    23   1     0.15   0.00  -0.01     0.23   0.02  -0.15    -0.19  -0.02   0.28
    24   1    -0.18   0.07   0.11    -0.04   0.13  -0.04    -0.27  -0.06   0.25
    25   1    -0.03   0.09  -0.16    -0.00   0.18  -0.18    -0.04   0.02  -0.04
    26   1    -0.05  -0.05   0.10    -0.03   0.13  -0.09    -0.07  -0.12   0.21
    27   1    -0.06  -0.02   0.02    -0.02  -0.03   0.11    -0.09  -0.07   0.10
                     28                     29                     30
                      A                      A                      A
 Frequencies --    966.2582              1002.9684              1032.5153
 Red. masses --      1.6050                 1.7337                 1.4950
 Frc consts  --      0.8829                 1.0276                 0.9390
 IR Inten    --      2.4686                 0.0792                 0.7856
 RamAct Fr= 1--      3.7738                 1.8612                 1.7555
  Dep-P Fr= 1--      0.7416                 0.6357                 0.7397
  Dep-U Fr= 1--      0.8516                 0.7773                 0.8503
 Alpha2 Fr= 1--      0.0005                 0.0039                 0.0003
 Beta2  Fr= 1--      0.5357                 0.2411                 0.2488
 AlphaG Fr= 1--     -0.0011                 0.0136                -0.0007
 Gamma2 Fr= 1--      0.0826                 0.2641                -0.2818
 Delta2 Fr= 1--     -1.2077                 0.2024                -0.3930
 Raman1 Fr= 1--      15.095                  7.445                  7.022
 ROA1   Fr= 1--     -30.718                 31.834                -39.625
 CID1   Fr= 1--      -2.035                  4.276                 -5.643
 Raman2 Fr= 1--       6.428                  2.894                  2.986
 ROA2   Fr= 1--      11.644                  4.720                 -3.618
 CID2   Fr= 1--       1.812                  1.631                 -1.212
 Raman3 Fr= 1--      12.856                  5.787                  5.971
 ROA3   Fr= 1--     -30.718                 31.834                -39.625
 CID3   Fr= 1--      -2.389                  5.501                 -6.636
 RC180  Fr= 1--       0.703                  0.555                  0.701
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.11   0.04   0.03     0.02  -0.00  -0.01    -0.01  -0.01   0.02
     2   6     0.00  -0.01   0.03     0.01  -0.00  -0.03    -0.01  -0.01   0.01
     3   6     0.03   0.05   0.03    -0.01  -0.09  -0.03    -0.01   0.04  -0.01
     4   6    -0.03  -0.04  -0.02     0.02   0.03   0.12    -0.00  -0.01  -0.06
     5   6     0.02  -0.01  -0.01     0.08   0.03  -0.11    -0.06  -0.03   0.09
     6   6     0.00  -0.00  -0.04    -0.00   0.02  -0.01     0.02  -0.05   0.02
     7   6    -0.00  -0.02   0.04    -0.08   0.00   0.03     0.03   0.04  -0.03
     8   6     0.02  -0.02   0.03    -0.01   0.02  -0.00     0.03   0.01  -0.03
     9   8     0.00   0.00   0.01    -0.00   0.00   0.00     0.01   0.01  -0.00
    10   6     0.10  -0.04  -0.03    -0.04  -0.05  -0.02    -0.02  -0.07  -0.05
    11   6    -0.10   0.05   0.02     0.04   0.06   0.05     0.04   0.08   0.03
    12   1     0.03   0.08   0.01    -0.01   0.07  -0.12    -0.02  -0.12   0.06
    13   1     0.04   0.09   0.03    -0.09  -0.19   0.07     0.04   0.09  -0.07
    14   1    -0.01  -0.03  -0.06     0.13   0.11   0.26    -0.08  -0.07  -0.18
    15   1    -0.02  -0.06  -0.02     0.04  -0.02   0.15    -0.01   0.03  -0.05
    16   1    -0.14   0.04   0.03    -0.07   0.01   0.04     0.07  -0.06  -0.04
    17   1     0.01  -0.05  -0.12    -0.27  -0.12  -0.03     0.19   0.16   0.11
    18   1     0.16  -0.07  -0.10     0.23   0.02  -0.26    -0.19  -0.08   0.27
    19   1     0.01   0.15   0.02     0.00  -0.06  -0.02    -0.05   0.00   0.09
    20   1    -0.06  -0.11  -0.07     0.04   0.04   0.02    -0.03   0.17   0.10
    21   1    -0.03   0.01  -0.05     0.03   0.05   0.03    -0.05  -0.21  -0.02
    22   1    -0.02   0.05  -0.01    -0.00   0.13   0.09     0.07   0.13   0.08
    23   1     0.21  -0.01  -0.15     0.30  -0.00  -0.07     0.37  -0.02  -0.06
    24   1     0.13   0.03  -0.10    -0.25   0.15   0.13    -0.28   0.16   0.15
    25   1     0.08  -0.40   0.46    -0.05  -0.11  -0.12    -0.05  -0.09  -0.14
    26   1     0.18   0.00  -0.24    -0.03  -0.29   0.27    -0.03  -0.26   0.25
    27   1     0.21   0.19  -0.38    -0.06   0.10  -0.31    -0.06   0.12  -0.32
                     31                     32                     33
                      A                      A                      A
 Frequencies --   1039.7231              1057.4110              1102.1967
 Red. masses --      1.9694                 2.1714                 1.3159
 Frc consts  --      1.2544                 1.4305                 0.9419
 IR Inten    --     22.3124                20.8080                 1.8891
 RamAct Fr= 1--      2.3431                 1.1433                 1.4911
  Dep-P Fr= 1--      0.6961                 0.6667                 0.6771
  Dep-U Fr= 1--      0.8208                 0.8000                 0.8075
 Alpha2 Fr= 1--      0.0022                 0.0017                 0.0019
 Beta2  Fr= 1--      0.3205                 0.1524                 0.2007
 AlphaG Fr= 1--      0.0103                -0.0106                -0.0052
 Gamma2 Fr= 1--      0.0905                -0.4806                -0.9402
 Delta2 Fr= 1--      0.2880                 0.3153                -0.4766
 Raman1 Fr= 1--       9.372                  4.573                  5.965
 ROA1   Fr= 1--      17.904                -36.050               -105.512
 CID1   Fr= 1--       1.910                 -7.883                -17.690
 Raman2 Fr= 1--       3.846                  1.829                  2.408
 ROA2   Fr= 1--      -0.132                -14.058                -18.753
 CID2   Fr= 1--      -0.034                 -7.685                 -7.787
 Raman3 Fr= 1--       7.693                  3.659                  4.816
 ROA3   Fr= 1--      17.904                -36.050               -105.512
 CID3   Fr= 1--       2.327                 -9.853                -21.907
 RC180  Fr= 1--       0.642                  0.600                  0.615
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01   0.02  -0.01    -0.00   0.01  -0.03     0.02   0.01  -0.03
     2   6     0.01   0.08   0.01     0.04   0.05  -0.01    -0.03   0.01   0.05
     3   6    -0.07  -0.01   0.02     0.09  -0.01  -0.01     0.02  -0.01  -0.03
     4   6     0.07  -0.03   0.02    -0.08  -0.03  -0.02    -0.05   0.03   0.02
     5   6    -0.01   0.01  -0.05     0.09  -0.00   0.07     0.04  -0.01  -0.01
     6   6    -0.05   0.18   0.05    -0.03   0.10   0.18     0.00   0.00   0.09
     7   6    -0.00  -0.12   0.00    -0.02  -0.05  -0.12    -0.00  -0.01  -0.05
     8   6     0.08  -0.08  -0.03    -0.05  -0.03  -0.01     0.03   0.00  -0.05
     9   8     0.03  -0.02  -0.01    -0.00  -0.02  -0.03     0.00  -0.00  -0.02
    10   6    -0.02  -0.03  -0.02    -0.02   0.01  -0.03    -0.01   0.01   0.01
    11   6    -0.02  -0.02   0.00    -0.02   0.01   0.02    -0.02  -0.01   0.00
    12   1     0.01  -0.14   0.15     0.11   0.47  -0.23    -0.15  -0.28  -0.04
    13   1     0.03   0.03  -0.14    -0.09  -0.22   0.20     0.03   0.14   0.04
    14   1    -0.06  -0.08   0.24     0.11   0.08  -0.11     0.03   0.06  -0.18
    15   1    -0.00   0.16  -0.06    -0.10  -0.29  -0.23     0.10   0.00   0.42
    16   1     0.04   0.18   0.06     0.08  -0.16  -0.13    -0.42  -0.33  -0.15
    17   1     0.09  -0.11  -0.18    -0.10  -0.05   0.08     0.20   0.13   0.07
    18   1    -0.38   0.37   0.04    -0.12  -0.02   0.30     0.20   0.10  -0.25
    19   1    -0.04   0.21   0.12     0.02  -0.22  -0.12    -0.06  -0.06   0.08
    20   1    -0.16  -0.02  -0.02     0.09  -0.08  -0.03    -0.02   0.18   0.10
    21   1    -0.16  -0.38  -0.18     0.07   0.11   0.06    -0.04  -0.25  -0.01
    22   1     0.03   0.06   0.04     0.12  -0.02  -0.02    -0.05  -0.00   0.00
    23   1     0.14  -0.00  -0.01     0.01   0.00   0.04    -0.04   0.01  -0.00
    24   1    -0.15   0.09   0.07    -0.10   0.01   0.07     0.02  -0.00  -0.01
    25   1     0.02  -0.01   0.08     0.01  -0.10   0.10     0.02  -0.03   0.09
    26   1     0.02   0.07  -0.08     0.03  -0.03  -0.02     0.02   0.04  -0.06
    27   1     0.04  -0.02   0.06     0.02   0.04  -0.07     0.03  -0.01   0.03
                     34                     35                     36
                      A                      A                      A
 Frequencies --   1120.4900              1150.6750              1173.3680
 Red. masses --      1.4432                 2.0119                 2.4792
 Frc consts  --      1.0676                 1.5695                 2.0111
 IR Inten    --      3.7993                 1.0148                 0.5374
 RamAct Fr= 1--      4.6113                 0.9741                 3.4224
  Dep-P Fr= 1--      0.7408                 0.6966                 0.7499
  Dep-U Fr= 1--      0.8511                 0.8211                 0.8571
 Alpha2 Fr= 1--      0.0007                 0.0009                 0.0000
 Beta2  Fr= 1--      0.6541                 0.1333                 0.4889
 AlphaG Fr= 1--     -0.0008                 0.0101                 0.0019
 Gamma2 Fr= 1--      0.8356                -0.4170                 1.2662
 Delta2 Fr= 1--      0.1278                -0.7135                 0.0699
 Raman1 Fr= 1--      18.445                  3.897                 13.689
 ROA1   Fr= 1--      84.308                -62.868                123.791
 CID1   Fr= 1--       4.571                -16.134                  9.043
 Raman2 Fr= 1--       7.849                  1.600                  5.867
 ROA2   Fr= 1--      19.033                 -4.301                 29.829
 CID2   Fr= 1--       2.425                 -2.688                  5.085
 Raman3 Fr= 1--      15.699                  3.200                 11.733
 ROA3   Fr= 1--      84.308                -62.868                123.791
 CID3   Fr= 1--       5.370                -19.649                 10.551
 RC180  Fr= 1--       0.702                  0.642                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02   0.03   0.06    -0.11  -0.06   0.11    -0.03   0.07   0.16
     2   6     0.07  -0.01   0.07    -0.04  -0.04   0.14    -0.14   0.11  -0.08
     3   6     0.00   0.03  -0.02     0.03   0.04  -0.07     0.09  -0.05   0.03
     4   6     0.04  -0.01  -0.03    -0.03  -0.01  -0.01    -0.07   0.07  -0.03
     5   6    -0.01  -0.03   0.00    -0.00   0.03   0.03     0.03  -0.12   0.01
     6   6     0.02  -0.06  -0.03    -0.02   0.07  -0.04     0.04  -0.08  -0.00
     7   6    -0.02   0.01   0.03     0.06  -0.02  -0.01    -0.03   0.04  -0.02
     8   6    -0.07   0.02  -0.05     0.03   0.03  -0.09     0.06  -0.05   0.04
     9   8    -0.01   0.01   0.01     0.01  -0.02   0.00     0.02   0.02  -0.00
    10   6    -0.02  -0.00  -0.06     0.05   0.03  -0.03     0.02  -0.04  -0.05
    11   6    -0.05  -0.01  -0.03     0.03   0.02  -0.05     0.02  -0.04  -0.06
    12   1     0.02  -0.01   0.01    -0.05  -0.04  -0.10    -0.15  -0.09  -0.16
    13   1    -0.10  -0.27   0.01    -0.08  -0.14   0.05    -0.03  -0.03   0.27
    14   1     0.07   0.05   0.37     0.07   0.07   0.15     0.20   0.26   0.19
    15   1     0.01   0.09  -0.05    -0.00  -0.03   0.05    -0.02  -0.20  -0.06
    16   1    -0.09  -0.01   0.02     0.18   0.10   0.02     0.16  -0.00  -0.00
    17   1     0.25   0.18   0.05    -0.44  -0.35  -0.14    -0.07   0.05   0.10
    18   1    -0.16   0.35  -0.16     0.16  -0.12  -0.01    -0.03   0.17  -0.16
    19   1    -0.02  -0.35  -0.09    -0.11  -0.15   0.14     0.01   0.29   0.08
    20   1     0.17   0.12   0.09     0.00   0.32   0.18    -0.20  -0.17  -0.12
    21   1     0.11   0.07   0.16    -0.02  -0.33   0.04    -0.13  -0.08  -0.19
    22   1     0.22  -0.00  -0.02     0.17  -0.10  -0.08     0.15   0.06   0.02
    23   1     0.06  -0.01   0.10    -0.07  -0.01   0.07     0.20  -0.02   0.01
    24   1    -0.20   0.03   0.14     0.08  -0.11   0.00    -0.11   0.06   0.06
    25   1     0.04  -0.02   0.15    -0.02   0.10  -0.17     0.02   0.21  -0.07
    26   1     0.05   0.14  -0.20    -0.04   0.03   0.01    -0.07   0.19  -0.07
    27   1     0.09   0.01   0.03    -0.06  -0.00  -0.01    -0.01  -0.08   0.19
                     37                     38                     39
                      A                      A                      A
 Frequencies --   1191.9830              1218.6914              1228.3190
 Red. masses --      1.6685                 1.9588                 1.7583
 Frc consts  --      1.3967                 1.7141                 1.5630
 IR Inten    --      3.3791                 1.0053                 3.2303
 RamAct Fr= 1--      1.7884                 1.8908                 2.3324
  Dep-P Fr= 1--      0.7458                 0.7096                 0.6218
  Dep-U Fr= 1--      0.8544                 0.8301                 0.7668
 Alpha2 Fr= 1--      0.0001                 0.0013                 0.0055
 Beta2  Fr= 1--      0.2547                 0.2616                 0.2981
 AlphaG Fr= 1--      0.0002                 0.0053                -0.0259
 Gamma2 Fr= 1--      0.9886                -1.0838                -0.5167
 Delta2 Fr= 1--      0.4491                -0.8202                -0.8291
 Raman1 Fr= 1--       7.154                  7.563                  9.329
 ROA1   Fr= 1--     109.281               -130.288                -76.135
 CID1   Fr= 1--      15.276                -17.226                 -8.161
 Raman2 Fr= 1--       3.056                  3.139                  3.577
 ROA2   Fr= 1--      20.134                -19.448                 -5.769
 CID2   Fr= 1--       6.588                 -6.195                 -1.613
 Raman3 Fr= 1--       6.112                  6.278                  7.154
 ROA3   Fr= 1--     109.281               -130.288                -76.135
 CID3   Fr= 1--      17.879                -20.752                -10.642
 RC180  Fr= 1--       0.709                  0.660                  0.534
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.08  -0.09  -0.00    -0.10  -0.05   0.04    -0.08   0.17   0.03
     2   6    -0.10  -0.11  -0.06     0.08   0.15  -0.07    -0.02  -0.03   0.03
     3   6     0.01  -0.03   0.01    -0.04   0.05   0.04    -0.02  -0.02  -0.01
     4   6     0.05   0.01  -0.01     0.06  -0.03  -0.04     0.04  -0.03   0.01
     5   6    -0.00   0.03  -0.00    -0.07   0.00   0.04    -0.05   0.05  -0.06
     6   6     0.01  -0.01   0.05    -0.01  -0.01   0.05     0.00   0.00   0.04
     7   6     0.01  -0.00   0.02     0.08   0.01  -0.04     0.01  -0.04  -0.00
     8   6     0.05   0.05   0.02    -0.03  -0.06   0.04    -0.00   0.01  -0.03
     9   8     0.02   0.00  -0.01    -0.02  -0.01  -0.01     0.01   0.00  -0.01
    10   6     0.03   0.05   0.01     0.03   0.00  -0.01     0.02  -0.07   0.01
    11   6     0.03   0.04   0.00     0.05   0.03  -0.00     0.04  -0.07  -0.03
    12   1     0.12   0.37  -0.10     0.03  -0.08   0.16     0.19   0.44  -0.06
    13   1    -0.02  -0.09   0.03    -0.17  -0.47  -0.02    -0.03  -0.08  -0.01
    14   1     0.04   0.03   0.23    -0.11  -0.12   0.03    -0.06  -0.10   0.04
    15   1    -0.04   0.04  -0.25     0.11   0.23   0.27     0.00   0.07  -0.04
    16   1    -0.36  -0.16  -0.04    -0.23  -0.22  -0.11    -0.18  -0.09  -0.03
    17   1     0.25   0.14   0.03    -0.09  -0.10  -0.03     0.26   0.11  -0.02
    18   1    -0.20   0.40  -0.09     0.24   0.02  -0.29     0.18  -0.41   0.07
    19   1    -0.01   0.20   0.10     0.07  -0.01  -0.11    -0.03  -0.05   0.03
    20   1    -0.08   0.09   0.04     0.00  -0.26  -0.14     0.01   0.09   0.05
    21   1    -0.03   0.00  -0.04    -0.02   0.11  -0.05     0.01  -0.04   0.03
    22   1     0.04  -0.12  -0.08     0.05  -0.04  -0.03    -0.07   0.12   0.09
    23   1    -0.15   0.01   0.03     0.01  -0.00  -0.01     0.25  -0.01  -0.15
    24   1     0.14  -0.11  -0.05     0.06  -0.04  -0.02     0.02   0.13  -0.08
    25   1    -0.03  -0.04  -0.10    -0.03   0.04  -0.16     0.03   0.21  -0.07
    26   1    -0.02  -0.10   0.11    -0.05  -0.05   0.12    -0.13   0.13   0.05
    27   1    -0.07   0.04  -0.12    -0.11   0.01  -0.06    -0.08  -0.14   0.28
                     40                     41                     42
                      A                      A                      A
 Frequencies --   1248.4819              1268.2079              1275.5231
 Red. masses --      1.7892                 1.9539                 1.5113
 Frc consts  --      1.6431                 1.8516                 1.4487
 IR Inten    --      1.7872                 0.0451                 3.0669
 RamAct Fr= 1--      4.3046                 1.0376                 4.8411
  Dep-P Fr= 1--      0.5893                 0.5495                 0.7413
  Dep-U Fr= 1--      0.7416                 0.7093                 0.8515
 Alpha2 Fr= 1--      0.0129                 0.0040                 0.0007
 Beta2  Fr= 1--      0.5320                 0.1227                 0.6870
 AlphaG Fr= 1--      0.0152                -0.0026                -0.0010
 Gamma2 Fr= 1--      0.1305                 0.2095                 2.0124
 Delta2 Fr= 1--     -0.6402                 0.3927                 0.9943
 Raman1 Fr= 1--      17.219                  4.150                 19.364
 ROA1   Fr= 1--      -7.954                 32.677                225.002
 CID1   Fr= 1--      -0.462                  7.874                 11.619
 Raman2 Fr= 1--       6.384                  1.472                  8.244
 ROA2   Fr= 1--       8.255                  1.885                 40.342
 CID2   Fr= 1--       1.293                  1.281                  4.894
 Raman3 Fr= 1--      12.769                  2.944                 16.488
 ROA3   Fr= 1--      -7.954                 32.677                225.002
 CID3   Fr= 1--      -0.623                 11.101                 13.647
 RC180  Fr= 1--       0.483                  0.419                  0.703
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.07  -0.05   0.17    -0.10  -0.07   0.06    -0.06  -0.04   0.08
     2   6     0.00  -0.05  -0.06     0.02   0.07   0.03     0.11   0.02  -0.03
     3   6    -0.09  -0.05   0.02    -0.01   0.03  -0.04    -0.01  -0.06  -0.00
     4   6     0.03   0.04   0.00     0.00   0.00   0.09    -0.03   0.02   0.03
     5   6     0.02  -0.03  -0.02     0.09   0.05  -0.05    -0.04   0.05  -0.05
     6   6    -0.01   0.03   0.03     0.02  -0.04  -0.02    -0.01   0.01   0.04
     7   6     0.00   0.01  -0.01    -0.15  -0.09  -0.02     0.03  -0.02  -0.00
     8   6     0.00   0.02   0.01    -0.00  -0.02  -0.01    -0.04  -0.01   0.01
     9   8     0.00  -0.01  -0.01     0.02   0.02   0.01    -0.01  -0.00  -0.00
    10   6    -0.03   0.02  -0.07     0.03   0.04  -0.01     0.01   0.01  -0.03
    11   6    -0.04   0.01  -0.05     0.03   0.01  -0.01     0.02   0.01  -0.02
    12   1     0.19   0.41   0.03    -0.02  -0.12   0.03    -0.10  -0.28   0.02
    13   1     0.09   0.21  -0.20    -0.09  -0.16   0.01     0.24   0.62  -0.08
    14   1    -0.16  -0.13  -0.48    -0.10  -0.11  -0.43     0.11   0.14   0.24
    15   1     0.11   0.14   0.27    -0.04  -0.05  -0.05    -0.12  -0.18  -0.33
    16   1    -0.01  -0.02  -0.01     0.30   0.27   0.09    -0.22  -0.10  -0.04
    17   1    -0.12  -0.06   0.00     0.52   0.34   0.12     0.10   0.02  -0.02
    18   1     0.06  -0.05  -0.05     0.06   0.00   0.02     0.03  -0.16   0.05
    19   1     0.01   0.04  -0.00    -0.01  -0.04   0.00     0.04  -0.06  -0.09
    20   1    -0.00   0.02   0.01    -0.01  -0.04  -0.03     0.10  -0.06  -0.02
    21   1     0.01   0.06  -0.00    -0.01  -0.05  -0.01     0.03   0.06   0.05
    22   1     0.25  -0.01  -0.03     0.08  -0.10  -0.07     0.11  -0.04  -0.03
    23   1     0.02  -0.01   0.18    -0.07   0.01   0.03     0.03  -0.00   0.04
    24   1    -0.17  -0.05   0.14     0.09  -0.10  -0.02    -0.00  -0.05   0.01
    25   1     0.02   0.04   0.06    -0.02   0.04  -0.13    -0.01   0.04  -0.09
    26   1     0.05   0.11  -0.17    -0.03   0.00   0.04    -0.02   0.02   0.01
    27   1     0.10   0.04  -0.04    -0.07   0.00  -0.05    -0.05   0.00  -0.03
                     43                     44                     45
                      A                      A                      A
 Frequencies --   1302.5950              1328.2324              1335.7280
 Red. masses --      2.1532                 1.7044                 1.4893
 Frc consts  --      2.1526                 1.7717                 1.5655
 IR Inten    --      8.4663                 1.9652                 1.1022
 RamAct Fr= 1--      2.3198                 3.7616                 1.8584
  Dep-P Fr= 1--      0.7296                 0.6217                 0.7105
  Dep-U Fr= 1--      0.8437                 0.7667                 0.8308
 Alpha2 Fr= 1--      0.0008                 0.0088                 0.0013
 Beta2  Fr= 1--      0.3262                 0.4807                 0.2573
 AlphaG Fr= 1--      0.0142                 0.0004                 0.0105
 Gamma2 Fr= 1--      0.7684                 1.2418                -0.5359
 Delta2 Fr= 1--      1.1243                 0.7668                -0.4047
 Raman1 Fr= 1--       9.279                 15.046                  7.433
 ROA1   Fr= 1--     109.742                143.747                -64.395
 CID1   Fr= 1--      11.827                  9.554                 -8.663
 Raman2 Fr= 1--       3.914                  5.768                  3.088
 ROA2   Fr= 1--       9.447                 23.668                 -9.624
 CID2   Fr= 1--       2.413                  4.103                 -3.117
 Raman3 Fr= 1--       7.828                 11.536                  6.176
 ROA3   Fr= 1--     109.742                143.747                -64.395
 CID3   Fr= 1--      14.018                 12.460                -10.427
 RC180  Fr= 1--       0.687                  0.533                  0.662
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.13  -0.07   0.03     0.10  -0.05  -0.01     0.02  -0.05   0.02
     2   6    -0.08   0.13   0.06    -0.05   0.02   0.00    -0.02   0.03  -0.01
     3   6     0.04   0.02  -0.04     0.01  -0.03   0.01    -0.00  -0.01   0.03
     4   6     0.03  -0.02   0.10     0.02  -0.00  -0.04    -0.06  -0.06  -0.11
     5   6    -0.07   0.06  -0.11    -0.12   0.07   0.10     0.06   0.09  -0.05
     6   6     0.02  -0.05  -0.02    -0.01   0.02   0.01     0.01  -0.02  -0.01
     7   6     0.07   0.05   0.05    -0.04  -0.07  -0.06    -0.03  -0.01   0.01
     8   6     0.03  -0.03  -0.01     0.02  -0.00   0.00     0.01  -0.01   0.01
     9   8    -0.01   0.00   0.00     0.01   0.00  -0.00     0.00   0.01   0.00
    10   6    -0.03   0.03  -0.01    -0.02   0.01  -0.01    -0.01   0.02  -0.00
    11   6    -0.04   0.01  -0.01    -0.03   0.03  -0.00    -0.01   0.01  -0.00
    12   1     0.01   0.05  -0.07     0.02   0.14  -0.07     0.03   0.08   0.01
    13   1    -0.14  -0.29   0.12     0.04   0.06   0.00     0.01   0.02   0.02
    14   1    -0.07  -0.10  -0.12     0.08   0.07   0.28     0.12   0.10   0.44
    15   1    -0.14  -0.11  -0.41    -0.03   0.06  -0.16     0.15   0.13   0.57
    16   1    -0.38  -0.22  -0.05     0.27   0.16   0.01    -0.05   0.07   0.03
    17   1    -0.01  -0.03  -0.07     0.24   0.12   0.05     0.12   0.10   0.07
    18   1    -0.10  -0.35   0.24     0.59  -0.21  -0.40    -0.14  -0.29   0.45
    19   1    -0.02  -0.04   0.05    -0.00   0.02   0.03     0.01   0.03   0.00
    20   1    -0.12  -0.07  -0.06    -0.06   0.00  -0.01    -0.04  -0.03  -0.02
    21   1    -0.08  -0.15  -0.09    -0.04  -0.04  -0.05    -0.02   0.00  -0.04
    22   1     0.05  -0.02  -0.02     0.00   0.01   0.00     0.04  -0.05  -0.03
    23   1    -0.06   0.00   0.10    -0.02  -0.00   0.07    -0.02   0.01   0.04
    24   1    -0.07  -0.05   0.07    -0.05  -0.04   0.05     0.02  -0.06   0.01
    25   1     0.01  -0.06   0.10     0.01  -0.09   0.09    -0.00  -0.02   0.00
    26   1     0.08  -0.00  -0.12     0.06  -0.07  -0.05     0.03  -0.03  -0.02
    27   1     0.11   0.04  -0.03     0.08   0.04  -0.01     0.03   0.02  -0.02
                     46                     47                     48
                      A                      A                      A
 Frequencies --   1350.1459              1409.5625              1416.5965
 Red. masses --      2.3458                 1.2380                 1.2818
 Frc consts  --      2.5194                 1.4493                 1.5155
 IR Inten    --      5.1502                 6.8337                 6.7660
 RamAct Fr= 1--      4.2311                 0.0985                 0.4156
  Dep-P Fr= 1--      0.4571                 0.5060                 0.1738
  Dep-U Fr= 1--      0.6274                 0.6720                 0.2961
 Alpha2 Fr= 1--      0.0252                 0.0005                 0.0060
 Beta2  Fr= 1--      0.4424                 0.0110                 0.0205
 AlphaG Fr= 1--      0.0011                -0.0029                -0.0027
 Gamma2 Fr= 1--      0.5885                -0.0486                -0.0589
 Delta2 Fr= 1--     -0.3324                 0.0033                -0.0102
 Raman1 Fr= 1--      16.924                  0.394                  1.662
 ROA1   Fr= 1--      45.855                 -4.558                 -5.976
 CID1   Fr= 1--       2.709                -11.572                 -3.595
 Raman2 Fr= 1--       5.309                  0.132                  0.246
 ROA2   Fr= 1--      16.782                 -1.193                 -1.332
 CID2   Fr= 1--       3.161                 -9.014                 -5.410
 Raman3 Fr= 1--      10.618                  0.265                  0.492
 ROA3   Fr= 1--      45.855                 -4.558                 -5.976
 CID3   Fr= 1--       4.319                -17.221                -12.140
 RC180  Fr= 1--       0.255                  0.344                 -0.408
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.05  -0.03  -0.08     0.02   0.00  -0.02     0.00  -0.01   0.00
     2   6     0.02   0.20   0.15    -0.01   0.00   0.01     0.00   0.04   0.02
     3   6    -0.05  -0.14  -0.00     0.00  -0.00  -0.00    -0.00  -0.00  -0.00
     4   6     0.01   0.03  -0.03     0.00   0.00  -0.00     0.00  -0.00   0.00
     5   6     0.00  -0.06   0.03    -0.01  -0.00   0.01    -0.00  -0.00  -0.00
     6   6     0.02  -0.08  -0.07     0.00  -0.00  -0.00     0.01  -0.00  -0.00
     7   6     0.01   0.03   0.01     0.00  -0.00  -0.01     0.00   0.00   0.00
     8   6    -0.01  -0.04  -0.05     0.00  -0.00  -0.01    -0.02  -0.13  -0.06
     9   8    -0.00   0.01   0.01    -0.00  -0.00   0.00    -0.01  -0.00   0.00
    10   6     0.03   0.01   0.02    -0.10   0.02   0.04    -0.02   0.01   0.01
    11   6     0.02   0.01   0.03    -0.00  -0.05   0.08    -0.00   0.02  -0.03
    12   1     0.26   0.62  -0.11     0.03   0.01   0.01     0.00   0.01  -0.01
    13   1     0.15   0.43  -0.05    -0.02   0.01   0.04    -0.00  -0.01  -0.00
    14   1    -0.01   0.01  -0.02    -0.03  -0.02   0.02    -0.01  -0.01  -0.01
    15   1     0.04   0.03   0.05     0.01  -0.03  -0.01    -0.00  -0.01  -0.01
    16   1     0.05  -0.04   0.00    -0.02   0.04   0.00     0.00  -0.03  -0.00
    17   1    -0.06  -0.02  -0.02    -0.03  -0.00   0.06     0.00  -0.00  -0.02
    18   1    -0.10   0.23  -0.11     0.01   0.01  -0.02    -0.00  -0.01  -0.00
    19   1    -0.05  -0.15   0.02    -0.03   0.01   0.04    -0.14   0.54   0.12
    20   1    -0.01  -0.04  -0.04    -0.02   0.01   0.00     0.07   0.34   0.36
    21   1    -0.02  -0.18   0.02     0.02   0.01   0.02     0.31   0.43   0.13
    22   1    -0.12  -0.05  -0.03     0.37  -0.16   0.01     0.07  -0.03  -0.00
    23   1    -0.13   0.00  -0.07     0.42   0.09  -0.11     0.10   0.02   0.01
    24   1     0.03   0.02   0.00     0.30  -0.18  -0.29     0.07  -0.08  -0.06
    25   1    -0.03  -0.05  -0.07    -0.13   0.19  -0.25     0.04  -0.07   0.09
    26   1     0.00  -0.01   0.04     0.11   0.28  -0.22    -0.02  -0.15   0.08
    27   1    -0.08   0.01  -0.08     0.01   0.05  -0.37     0.03  -0.01   0.15
                     49                     50                     51
                      A                      A                      A
 Frequencies --   1430.9992              1462.3304              1485.5140
 Red. masses --      1.2098                 1.0861                 1.0531
 Frc consts  --      1.4596                 1.3684                 1.3692
 IR Inten    --     11.1322                12.1873                 3.9119
 RamAct Fr= 1--      0.9710                 7.8371                 2.3831
  Dep-P Fr= 1--      0.1004                 0.6317                 0.7500
  Dep-U Fr= 1--      0.1824                 0.7743                 0.8571
 Alpha2 Fr= 1--      0.0170                 0.0168                 0.0000
 Beta2  Fr= 1--      0.0295                 1.0113                 0.3404
 AlphaG Fr= 1--     -0.0252                 0.0248                 0.0000
 Gamma2 Fr= 1--      0.0109                 1.2887                 0.7743
 Delta2 Fr= 1--      0.0476                 0.9213                 0.1630
 Raman1 Fr= 1--       3.884                 31.348                  9.532
 ROA1   Fr= 1--       2.568                153.198                 79.549
 CID1   Fr= 1--       0.661                  4.887                  8.345
 Raman2 Fr= 1--       0.354                 12.136                  4.085
 ROA2   Fr= 1--      -0.119                 23.559                 17.280
 CID2   Fr= 1--      -0.337                  1.941                  4.230
 Raman3 Fr= 1--       0.709                 24.272                  8.170
 ROA3   Fr= 1--       2.568                153.198                 79.549
 CID3   Fr= 1--       3.624                  6.312                  9.736
 RC180  Fr= 1--      -0.635                  0.549                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.00    -0.00   0.00  -0.00    -0.01  -0.01   0.01
     2   6     0.00  -0.00   0.01    -0.00   0.01   0.01    -0.00  -0.00   0.01
     3   6    -0.01  -0.01  -0.01    -0.00  -0.00  -0.00    -0.01  -0.01  -0.03
     4   6     0.00   0.01  -0.00     0.01   0.02   0.00    -0.01  -0.01   0.00
     5   6     0.01  -0.01   0.00    -0.01  -0.01  -0.00     0.00  -0.00  -0.00
     6   6    -0.00  -0.00  -0.01     0.00  -0.01  -0.01     0.00   0.00  -0.00
     7   6    -0.01   0.01   0.01     0.05  -0.04  -0.05     0.00  -0.00  -0.00
     8   6     0.00   0.04   0.01    -0.00   0.00   0.00    -0.00  -0.01   0.02
     9   8     0.00   0.00   0.00     0.00   0.00   0.00    -0.00  -0.00  -0.00
    10   6    -0.08   0.02   0.03    -0.00   0.00   0.01    -0.00  -0.03   0.01
    11   6    -0.00   0.05  -0.08    -0.01   0.00  -0.02    -0.01   0.02   0.01
    12   1     0.04   0.01   0.03     0.01   0.01   0.01     0.20  -0.03   0.18
    13   1    -0.01   0.04   0.03    -0.00   0.01   0.01    -0.12   0.09   0.25
    14   1    -0.03  -0.01  -0.01    -0.11  -0.06   0.02     0.10   0.06  -0.05
    15   1     0.01  -0.02   0.01     0.03  -0.12  -0.01    -0.03   0.12  -0.02
    16   1     0.07  -0.09  -0.00    -0.36   0.54   0.03    -0.03   0.03   0.00
    17   1     0.01  -0.01  -0.12    -0.18   0.02   0.63    -0.01   0.00   0.04
    18   1    -0.03   0.04  -0.01    -0.01   0.02  -0.02     0.00   0.01  -0.01
    19   1     0.04  -0.15  -0.04     0.01  -0.01  -0.02     0.15   0.01  -0.22
    20   1     0.02  -0.12  -0.12     0.02  -0.00  -0.00     0.04   0.13   0.14
    21   1    -0.09  -0.17  -0.01    -0.02  -0.03  -0.01    -0.14   0.04  -0.21
    22   1     0.30  -0.12   0.00     0.01  -0.06  -0.03     0.29   0.19   0.16
    23   1     0.34   0.07  -0.06     0.01   0.02  -0.08    -0.26  -0.05  -0.01
    24   1     0.24  -0.16  -0.23    -0.01   0.01   0.01     0.06   0.37  -0.25
    25   1     0.13  -0.23   0.26     0.06   0.11   0.11    -0.12  -0.09  -0.22
    26   1    -0.09  -0.34   0.22    -0.06  -0.13   0.11     0.23  -0.16  -0.15
    27   1     0.01  -0.05   0.42     0.16   0.02   0.04     0.07  -0.00   0.16
                     52                     53                     54
                      A                      A                      A
 Frequencies --   1489.5300              1493.7232              1498.9674
 Red. masses --      1.0481                 1.0511                 1.0556
 Frc consts  --      1.3700                 1.3817                 1.3975
 IR Inten    --      6.7730                 5.9657                 4.0733
 RamAct Fr= 1--      8.0540                 3.7633                 1.4285
  Dep-P Fr= 1--      0.7295                 0.6747                 0.7446
  Dep-U Fr= 1--      0.8436                 0.8057                 0.8536
 Alpha2 Fr= 1--      0.0028                 0.0050                 0.0001
 Beta2  Fr= 1--      1.1324                 0.5054                 0.2032
 AlphaG Fr= 1--      0.0070                 0.0050                 0.0014
 Gamma2 Fr= 1--     -2.4647                 0.5862                -1.6203
 Delta2 Fr= 1--     -0.9603                 0.1687                -0.5831
 Raman1 Fr= 1--      32.216                 15.053                  5.714
 ROA1   Fr= 1--    -267.344                 61.674               -174.213
 CID1   Fr= 1--      -8.299                  4.097                -30.489
 Raman2 Fr= 1--      13.588                  6.064                  2.439
 ROA2   Fr= 1--     -51.471                 12.719                -34.223
 CID2   Fr= 1--      -3.788                  2.097                -14.034
 Raman3 Fr= 1--      27.177                 12.129                  4.877
 ROA3   Fr= 1--    -267.344                 61.674               -174.213
 CID3   Fr= 1--      -9.837                  5.085                -35.719
 RC180  Fr= 1--       0.687                  0.611                  0.707
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.00     0.00   0.00   0.01     0.00  -0.00  -0.01
     2   6    -0.00   0.00  -0.02    -0.02   0.00  -0.01    -0.02   0.00   0.00
     3   6    -0.00  -0.00  -0.00     0.00   0.00   0.01    -0.00  -0.01  -0.03
     4   6    -0.00  -0.01   0.00     0.01   0.01  -0.01    -0.01  -0.03   0.01
     5   6     0.00  -0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
     6   6     0.00  -0.00  -0.00    -0.00  -0.00   0.00    -0.00  -0.00  -0.00
     7   6     0.01  -0.01  -0.01    -0.01   0.00   0.00     0.00   0.00  -0.00
     8   6     0.00   0.02  -0.03    -0.04   0.02  -0.01    -0.03  -0.00   0.01
     9   8    -0.00  -0.00   0.00     0.00   0.00  -0.00     0.00   0.00   0.00
    10   6    -0.01  -0.01  -0.03     0.01   0.00   0.02    -0.00   0.01  -0.02
    11   6     0.01   0.02   0.01    -0.02   0.00   0.01     0.01  -0.02  -0.01
    12   1     0.04  -0.01   0.05    -0.06   0.02  -0.06     0.20  -0.02   0.17
    13   1    -0.03   0.01   0.06     0.02  -0.05  -0.06    -0.11   0.06   0.24
    14   1     0.10   0.05  -0.05    -0.10  -0.05   0.05     0.23   0.12  -0.10
    15   1    -0.03   0.11  -0.01     0.03  -0.10   0.02    -0.08   0.26  -0.04
    16   1    -0.08   0.12   0.01     0.04  -0.06  -0.00    -0.01   0.02   0.00
    17   1    -0.04   0.01   0.13     0.03   0.00  -0.06    -0.01  -0.00   0.03
    18   1    -0.01  -0.00  -0.00     0.01  -0.01   0.00    -0.01   0.01  -0.00
    19   1    -0.24   0.04   0.33     0.01   0.33  -0.06     0.16   0.23  -0.26
    20   1     0.01  -0.23  -0.23     0.51  -0.17  -0.07     0.39   0.00   0.08
    21   1     0.24  -0.11   0.38     0.06  -0.36   0.31    -0.11  -0.22   0.00
    22   1     0.01   0.31   0.16     0.02  -0.17  -0.08    -0.16   0.10   0.01
    23   1    -0.02  -0.06   0.33    -0.06   0.03  -0.23     0.14  -0.02   0.25
    24   1     0.11  -0.04  -0.13    -0.09   0.11   0.06     0.05  -0.25   0.05
    25   1    -0.06  -0.27  -0.11    -0.10   0.08  -0.18     0.10   0.11   0.18
    26   1     0.11   0.04  -0.11     0.19  -0.18  -0.11    -0.19   0.14   0.13
    27   1    -0.21  -0.05   0.11     0.21   0.03   0.10    -0.03   0.01  -0.17
                     55                     56                     57
                      A                      A                      A
 Frequencies --   1504.1911              1513.6522              1518.6476
 Red. masses --      1.0554                 1.0668                 1.0677
 Frc consts  --      1.4069                 1.4401                 1.4508
 IR Inten    --      3.8045                 0.4354                 6.1576
 RamAct Fr= 1--      2.1633                 3.9149                 1.9513
  Dep-P Fr= 1--      0.7358                 0.6914                 0.6773
  Dep-U Fr= 1--      0.8478                 0.8176                 0.8076
 Alpha2 Fr= 1--      0.0005                 0.0040                 0.0025
 Beta2  Fr= 1--      0.3057                 0.5334                 0.2626
 AlphaG Fr= 1--      0.0081                -0.0070                 0.0098
 Gamma2 Fr= 1--     -0.4943                 1.5458                 0.7713
 Delta2 Fr= 1--     -0.3288                 0.7297                 0.2656
 Raman1 Fr= 1--       8.653                 15.660                  7.805
 ROA1   Fr= 1--     -57.973                171.744                 82.546
 CID1   Fr= 1--      -6.700                 10.967                 10.576
 Raman2 Fr= 1--       3.668                  6.401                  3.152
 ROA2   Fr= 1--      -9.233                 31.260                 16.387
 CID2   Fr= 1--      -2.517                  4.883                  5.199
 Raman3 Fr= 1--       7.336                 12.803                  6.304
 ROA3   Fr= 1--     -57.973                171.744                 82.546
 CID3   Fr= 1--      -7.903                 13.415                 13.095
 RC180  Fr= 1--       0.696                  0.635                  0.615
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.02   0.01    -0.03   0.02  -0.01     0.01   0.03   0.01
     2   6     0.01  -0.00  -0.02     0.01   0.00   0.00     0.00  -0.01  -0.01
     3   6    -0.01  -0.01  -0.03    -0.00  -0.00   0.01    -0.01  -0.00  -0.05
     4   6    -0.01  -0.01  -0.00    -0.01  -0.03   0.01     0.00   0.01  -0.01
     5   6    -0.00   0.00   0.00     0.00  -0.01  -0.00    -0.00  -0.00   0.00
     6   6     0.00   0.01   0.00    -0.00  -0.00   0.00     0.00   0.01   0.00
     7   6    -0.01   0.00   0.00     0.00   0.00   0.00     0.00  -0.00  -0.00
     8   6     0.01   0.01  -0.02     0.01   0.00  -0.00     0.01   0.00  -0.00
     9   8    -0.00  -0.00  -0.00     0.00   0.00  -0.00    -0.00  -0.00  -0.00
    10   6     0.00  -0.01   0.02     0.01   0.01  -0.02     0.01   0.02   0.01
    11   6    -0.01  -0.02  -0.02    -0.04  -0.00   0.02     0.01   0.02   0.01
    12   1     0.20  -0.06   0.20    -0.02   0.00  -0.01     0.31  -0.08   0.29
    13   1    -0.11   0.09   0.25     0.02   0.00  -0.03    -0.18   0.12   0.38
    14   1     0.13   0.07  -0.05     0.21   0.11  -0.10    -0.09  -0.04   0.04
    15   1    -0.04   0.16  -0.02    -0.07   0.24  -0.05     0.03  -0.10   0.01
    16   1     0.05  -0.07  -0.01    -0.00  -0.03  -0.00    -0.01   0.03   0.00
    17   1     0.02  -0.00  -0.08    -0.00  -0.01  -0.01    -0.01  -0.00   0.02
    18   1     0.01   0.00  -0.01    -0.02   0.02  -0.01     0.02  -0.01  -0.01
    19   1    -0.19  -0.05   0.28    -0.04  -0.13   0.07    -0.03  -0.03   0.05
    20   1    -0.14  -0.12  -0.15    -0.17   0.00  -0.03    -0.08   0.01  -0.01
    21   1     0.18   0.04   0.21     0.01   0.09  -0.04     0.03   0.06  -0.00
    22   1     0.15  -0.12  -0.03    -0.22   0.01  -0.05    -0.22  -0.30  -0.20
    23   1    -0.17   0.01  -0.25     0.19   0.00   0.16     0.14   0.06  -0.21
    24   1    -0.06   0.25  -0.04     0.02  -0.29   0.12    -0.15  -0.17   0.27
    25   1     0.11   0.32   0.20    -0.12   0.27  -0.23    -0.08  -0.27  -0.14
    26   1    -0.19  -0.02   0.18     0.24  -0.37  -0.08     0.14   0.04  -0.15
    27   1     0.24   0.07  -0.16     0.47   0.07   0.16    -0.20  -0.06   0.14
                     58                     59                     60
                      A                      A                      A
 Frequencies --   1527.4122              1817.0273              3033.6406
 Red. masses --      1.0784                12.5045                 1.0390
 Frc consts  --      1.4823                24.3243                 5.6335
 IR Inten    --      6.1613               250.4366                12.7168
 RamAct Fr= 1--      5.0238                18.9278                 7.8581
  Dep-P Fr= 1--      0.5033                 0.5144                 0.7310
  Dep-U Fr= 1--      0.6696                 0.6794                 0.8446
 Alpha2 Fr= 1--      0.0244                 0.0872                 0.0026
 Beta2  Fr= 1--      0.5607                 2.1432                 1.1061
 AlphaG Fr= 1--      0.0089                 0.1113                -0.0180
 Gamma2 Fr= 1--     -1.2635                 1.1150                 1.4899
 Delta2 Fr= 1--     -0.5261                 1.0054                 0.4367
 Raman1 Fr= 1--      20.095                 75.711                 31.432
 ROA1   Fr= 1--    -138.127                139.215                157.010
 CID1   Fr= 1--      -6.874                  1.839                  4.995
 Raman2 Fr= 1--       6.728                 25.718                 13.274
 ROA2   Fr= 1--     -26.115                 18.717                 32.265
 CID2   Fr= 1--      -3.881                  0.728                  2.431
 Raman3 Fr= 1--      13.456                 51.436                 26.547
 ROA3   Fr= 1--    -138.127                139.215                157.010
 CID3   Fr= 1--     -10.265                  2.707                  5.914
 RC180  Fr= 1--       0.339                  0.359                  0.689
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01   0.01   0.01    -0.03  -0.00  -0.00    -0.00  -0.00   0.00
     2   6    -0.00   0.00   0.00    -0.03  -0.01   0.00     0.00   0.00  -0.00
     3   6     0.00   0.00   0.03    -0.01  -0.01   0.01    -0.00   0.00   0.00
     4   6    -0.02  -0.05   0.03     0.00   0.00  -0.00    -0.00  -0.00   0.00
     5   6    -0.00  -0.01  -0.01    -0.02  -0.01  -0.01     0.00  -0.00  -0.00
     6   6     0.00  -0.00  -0.00     0.77   0.26  -0.01     0.00  -0.00   0.00
     7   6     0.01  -0.00  -0.01    -0.04  -0.01   0.00    -0.00   0.00   0.00
     8   6    -0.00  -0.00   0.00     0.01   0.01   0.00    -0.00   0.00   0.00
     9   8     0.00   0.00   0.00    -0.50  -0.17   0.01     0.00  -0.00   0.00
    10   6    -0.00   0.01   0.03     0.00  -0.00   0.00     0.04  -0.01   0.00
    11   6     0.01   0.01  -0.00     0.00  -0.00  -0.00    -0.01   0.02  -0.03
    12   1    -0.16   0.03  -0.15    -0.03   0.06  -0.04     0.01  -0.01  -0.01
    13   1     0.09  -0.07  -0.20     0.04   0.02  -0.04    -0.01   0.00  -0.01
    14   1     0.41   0.21  -0.20     0.01   0.01   0.01    -0.01   0.01  -0.00
    15   1    -0.15   0.48  -0.08    -0.01   0.01  -0.01     0.02   0.00  -0.01
    16   1    -0.07   0.09   0.00     0.05   0.07   0.02     0.00   0.01  -0.04
    17   1    -0.04  -0.00   0.11     0.08   0.06   0.04     0.01  -0.01   0.00
    18   1    -0.01  -0.02   0.01    -0.04  -0.02  -0.01     0.00   0.00   0.00
    19   1     0.01   0.01  -0.02     0.05  -0.01  -0.03    -0.01  -0.00  -0.01
    20   1     0.01   0.01   0.01     0.04  -0.01  -0.03     0.00   0.00  -0.00
    21   1    -0.01  -0.00  -0.01    -0.06  -0.10  -0.03     0.02  -0.01  -0.02
    22   1     0.08  -0.28  -0.12    -0.00   0.00   0.00    -0.02  -0.11   0.21
    23   1     0.00   0.06  -0.33     0.00   0.00   0.00    -0.04   0.41   0.06
    24   1    -0.08   0.10   0.06     0.01  -0.00  -0.01    -0.36  -0.16  -0.33
    25   1    -0.01  -0.22  -0.02     0.01   0.03   0.00    -0.27   0.02   0.12
    26   1     0.02   0.09  -0.06    -0.02  -0.02   0.02     0.34   0.17   0.33
    27   1    -0.22  -0.05   0.06     0.02   0.00   0.00     0.08  -0.39  -0.08
                     61                     62                     63
                      A                      A                      A
 Frequencies --   3037.2951              3040.4579              3056.8487
 Red. masses --      1.0368                 1.0381                 1.0593
 Frc consts  --      5.6353                 5.6540                 5.8321
 IR Inten    --     20.1726                40.3743                25.9292
 RamAct Fr= 1--     11.1052               380.7603                67.8623
  Dep-P Fr= 1--      0.6211                 0.0125                 0.3212
  Dep-U Fr= 1--      0.7663                 0.0246                 0.4863
 Alpha2 Fr= 1--      0.0262                 8.2181                 0.6525
 Beta2  Fr= 1--      1.4183                 1.5636                 5.4999
 AlphaG Fr= 1--      0.0298                 0.3529                -0.5227
 Gamma2 Fr= 1--      1.9537                 0.2538                 3.8725
 Delta2 Fr= 1--      1.0991                -1.2508                -3.6559
 Raman1 Fr= 1--      44.421               1523.041                271.449
 ROA1   Fr= 1--     222.726                -15.660                254.775
 CID1   Fr= 1--       5.014                 -0.010                  0.939
 Raman2 Fr= 1--      17.020                 18.763                 65.999
 ROA2   Fr= 1--      38.095                 16.099                122.188
 CID2   Fr= 1--       2.238                  0.858                  1.851
 Raman3 Fr= 1--      34.039                 37.527                131.998
 ROA3   Fr= 1--     222.726                -15.660                254.775
 CID3   Fr= 1--       6.543                 -0.417                  1.930
 RC180  Fr= 1--       0.533                 -0.951                 -0.027
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.00  -0.00    -0.00   0.00  -0.00     0.00   0.00   0.00
     2   6    -0.00  -0.00  -0.00     0.00   0.00   0.00     0.00  -0.00  -0.00
     3   6    -0.00  -0.00  -0.00    -0.00  -0.00  -0.01    -0.01  -0.01  -0.06
     4   6    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.01  -0.03   0.01
     5   6    -0.00  -0.00  -0.00     0.00   0.00   0.00     0.00   0.00   0.00
     6   6     0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.00   0.00   0.00
     7   6     0.00  -0.00  -0.00    -0.00   0.00   0.00    -0.00   0.00  -0.00
     8   6    -0.00   0.04   0.02     0.00   0.03   0.01    -0.00  -0.00  -0.00
     9   8    -0.00  -0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
    10   6     0.02  -0.01   0.00    -0.03   0.01  -0.00     0.00  -0.00   0.00
    11   6     0.01  -0.01   0.02    -0.01   0.01  -0.02    -0.00   0.00   0.00
    12   1    -0.02   0.01   0.02    -0.05   0.03   0.05    -0.39   0.22   0.42
    13   1     0.02  -0.01   0.01     0.05  -0.01   0.02     0.51  -0.16   0.25
    14   1    -0.01   0.01  -0.00     0.01  -0.01   0.00    -0.22   0.33  -0.03
    15   1     0.02   0.00  -0.01    -0.02  -0.00   0.01     0.29   0.05  -0.10
    16   1    -0.00  -0.00   0.03     0.00   0.01  -0.04    -0.00  -0.00   0.01
    17   1    -0.01   0.01  -0.00     0.01  -0.02   0.01     0.01  -0.03   0.01
    18   1     0.01   0.01   0.01    -0.02  -0.01  -0.02    -0.03  -0.03  -0.03
    19   1    -0.33   0.00  -0.22    -0.28   0.00  -0.18     0.03   0.00   0.02
    20   1    -0.06  -0.27   0.32    -0.04  -0.22   0.26     0.01   0.03  -0.04
    21   1     0.39  -0.14  -0.28     0.32  -0.12  -0.23    -0.03   0.01   0.02
    22   1    -0.02  -0.07   0.13     0.02   0.09  -0.17    -0.00  -0.00   0.00
    23   1    -0.03   0.26   0.04     0.03  -0.30  -0.05    -0.00   0.02   0.00
    24   1    -0.22  -0.10  -0.20     0.30   0.13   0.27    -0.02  -0.01  -0.01
    25   1     0.18  -0.01  -0.08    -0.22   0.02   0.10     0.01  -0.00  -0.00
    26   1    -0.21  -0.11  -0.21     0.26   0.13   0.25    -0.01  -0.00  -0.01
    27   1    -0.05   0.26   0.05     0.05  -0.27  -0.06    -0.00   0.00   0.00
                     64                     65                     66
                      A                      A                      A
 Frequencies --   3063.1629              3065.3348              3084.3553
 Red. masses --      1.0612                 1.0625                 1.1007
 Frc consts  --      5.8665                 5.8822                 6.1693
 IR Inten    --     14.2941                29.8651                 9.9683
 RamAct Fr= 1--     58.6499               242.4439                86.4182
  Dep-P Fr= 1--      0.1996                 0.0499                 0.1845
  Dep-U Fr= 1--      0.3328                 0.0950                 0.3115
 Alpha2 Fr= 1--      0.7973                 4.7906                 1.2224
 Beta2  Fr= 1--      3.2532                 3.8379                 4.4870
 AlphaG Fr= 1--      0.1473                -0.7859                -0.7194
 Gamma2 Fr= 1--     -3.1633                -5.4695               -14.9178
 Delta2 Fr= 1--     -3.5887                -0.4453               -10.7236
 Raman1 Fr= 1--     234.600                969.776                345.673
 ROA1   Fr= 1--    -418.517               -539.322              -1775.268
 CID1   Fr= 1--      -1.784                 -0.556                 -5.136
 Raman2 Fr= 1--      39.038                 46.055                 53.844
 ROA2   Fr= 1--     -47.210               -127.705               -272.240
 CID2   Fr= 1--      -1.209                 -2.773                 -5.056
 Raman3 Fr= 1--      78.076                 92.110                107.689
 ROA3   Fr= 1--    -418.517               -539.322              -1775.268
 CID3   Fr= 1--      -5.360                 -5.855                -16.485
 RC180  Fr= 1--      -0.334                 -0.810                 -0.377
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00   0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
     2   6    -0.00  -0.00   0.00    -0.00   0.00   0.00    -0.00   0.00   0.00
     3   6     0.00  -0.00  -0.01     0.00   0.01   0.03    -0.05   0.02   0.01
     4   6    -0.00   0.02  -0.00    -0.01  -0.05   0.02     0.05  -0.02  -0.01
     5   6     0.01   0.01   0.01     0.02   0.01   0.01    -0.03  -0.02  -0.03
     6   6     0.00   0.00   0.00     0.00  -0.00  -0.00     0.00   0.00  -0.00
     7   6     0.03  -0.04  -0.04     0.01  -0.01  -0.01     0.01  -0.01  -0.00
     8   6    -0.00  -0.00   0.00     0.00   0.00   0.00     0.00   0.00  -0.00
     9   8     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00  -0.00   0.00
    10   6     0.00  -0.00   0.00    -0.00   0.00  -0.01    -0.00  -0.00  -0.00
    11   6    -0.01   0.00  -0.00    -0.00  -0.00  -0.00     0.00   0.01   0.00
    12   1    -0.08   0.04   0.08     0.24  -0.14  -0.26     0.27  -0.16  -0.32
    13   1     0.07  -0.02   0.03    -0.26   0.08  -0.12     0.37  -0.11   0.20
    14   1     0.11  -0.18   0.01    -0.34   0.51  -0.04    -0.21   0.34  -0.04
    15   1    -0.09  -0.01   0.03     0.46   0.08  -0.16    -0.34  -0.07   0.12
    16   1    -0.05  -0.12   0.60    -0.02  -0.03   0.17    -0.01  -0.02   0.08
    17   1    -0.35   0.60  -0.17    -0.06   0.11  -0.03    -0.07   0.12  -0.03
    18   1    -0.09  -0.07  -0.09    -0.18  -0.14  -0.17     0.32   0.25   0.31
    19   1     0.00   0.00   0.00    -0.01  -0.00  -0.01    -0.03   0.00  -0.02
    20   1     0.00   0.00  -0.00    -0.00  -0.02   0.02    -0.00  -0.01   0.01
    21   1     0.00  -0.00  -0.00     0.02  -0.01  -0.01    -0.02   0.00   0.01
    22   1     0.00   0.00  -0.01    -0.01  -0.02   0.03     0.00   0.01  -0.01
    23   1    -0.00   0.01   0.00     0.00  -0.02  -0.01    -0.00   0.02   0.00
    24   1    -0.00  -0.00  -0.00     0.05   0.02   0.04     0.03   0.01   0.02
    25   1     0.04  -0.00  -0.02     0.01  -0.00  -0.01    -0.01   0.00   0.01
    26   1     0.05   0.03   0.05     0.02   0.01   0.02    -0.03  -0.01  -0.03
    27   1     0.01  -0.04  -0.01    -0.00  -0.01  -0.00     0.02  -0.08  -0.02
                     67                     68                     69
                      A                      A                      A
 Frequencies --   3084.5337              3087.8871              3091.7323
 Red. masses --      1.1005                 1.0917                 1.0996
 Frc consts  --      6.1693                 6.1329                 6.1926
 IR Inten    --      2.0292                24.8164                53.5781
 RamAct Fr= 1--     15.8031               197.8341                99.9851
  Dep-P Fr= 1--      0.5423                 0.0980                 0.7463
  Dep-U Fr= 1--      0.7033                 0.1786                 0.8547
 Alpha2 Fr= 1--      0.0630                 3.4805                 0.0063
 Beta2  Fr= 1--      1.8523                 5.8876                14.2431
 AlphaG Fr= 1--     -0.0169                 1.5191                -0.0418
 Gamma2 Fr= 1--     -1.1561                29.4265                -1.9264
 Delta2 Fr= 1--     -2.7816                12.8307                 0.3259
 Raman1 Fr= 1--      63.212                791.336                399.940
 ROA1   Fr= 1--    -199.997               3235.524               -174.511
 CID1   Fr= 1--      -3.164                  4.089                 -0.436
 Raman2 Fr= 1--      22.228                 70.651                170.917
 ROA2   Fr= 1--      -5.493                603.590                -48.842
 CID2   Fr= 1--      -0.247                  8.543                 -0.286
 Raman3 Fr= 1--      44.456                141.303                341.834
 ROA3   Fr= 1--    -199.997               3235.524               -174.511
 CID3   Fr= 1--      -4.499                 22.898                 -0.511
 RC180  Fr= 1--       0.407                 -0.643                  0.709
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00  -0.00
     2   6     0.00  -0.00   0.00     0.00   0.00   0.00     0.00   0.00   0.00
     3   6     0.00  -0.00  -0.00     0.04  -0.02  -0.00    -0.00  -0.00  -0.00
     4   6    -0.00   0.00  -0.00    -0.03  -0.01   0.01     0.00  -0.00   0.00
     5   6     0.00   0.00   0.00    -0.04  -0.03  -0.04    -0.01  -0.00  -0.01
     6   6    -0.00  -0.00  -0.00     0.00   0.00   0.00     0.00  -0.00  -0.00
     7   6    -0.00   0.00  -0.00     0.01  -0.01   0.00    -0.00   0.00  -0.00
     8   6    -0.01  -0.00   0.01    -0.00  -0.00   0.00    -0.00   0.00  -0.01
     9   8     0.00   0.00   0.00    -0.00  -0.00  -0.00     0.00   0.00   0.00
    10   6    -0.02  -0.06  -0.04    -0.00   0.00  -0.00    -0.01  -0.04  -0.02
    11   6     0.01   0.04   0.02     0.00   0.01   0.00    -0.03  -0.06  -0.04
    12   1    -0.02   0.01   0.02    -0.16   0.09   0.19    -0.00   0.00   0.00
    13   1    -0.02   0.01  -0.01    -0.33   0.10  -0.17     0.01  -0.00   0.00
    14   1     0.02  -0.03   0.00    -0.01   0.00   0.00    -0.01   0.01  -0.00
    15   1     0.00   0.00  -0.00     0.34   0.06  -0.12     0.00   0.00  -0.00
    16   1     0.00  -0.00   0.00    -0.00  -0.00   0.01    -0.00  -0.00   0.01
    17   1     0.01  -0.02   0.00    -0.10   0.17  -0.04     0.01  -0.01   0.00
    18   1    -0.04  -0.03  -0.04     0.48   0.37   0.47     0.07   0.06   0.07
    19   1     0.03  -0.00   0.02    -0.01  -0.00  -0.00     0.08   0.00   0.05
    20   1     0.01   0.07  -0.08     0.00   0.02  -0.02    -0.01  -0.05   0.05
    21   1     0.07  -0.03  -0.05     0.03  -0.01  -0.02    -0.02   0.01   0.01
    22   1    -0.01  -0.05   0.05    -0.00   0.00  -0.00    -0.01  -0.03   0.04
    23   1    -0.08   0.64   0.09     0.01  -0.04  -0.01    -0.05   0.38   0.05
    24   1     0.39   0.15   0.34     0.01   0.00   0.01     0.23   0.09   0.20
    25   1    -0.02   0.01   0.02    -0.03   0.00   0.02     0.07  -0.02  -0.04
    26   1    -0.22  -0.10  -0.21    -0.03  -0.01  -0.03     0.37   0.17   0.36
    27   1     0.08  -0.36  -0.07     0.02  -0.07  -0.01    -0.13   0.61   0.12
                     70                     71                     72
                      A                      A                      A
 Frequencies --   3098.4690              3100.5104              3103.7955
 Red. masses --      1.1038                 1.1016                 1.1014
 Frc consts  --      6.2437                 6.2392                 6.2514
 IR Inten    --      2.0379                14.7789                 9.8439
 RamAct Fr= 1--     37.1404                65.0957                73.2837
  Dep-P Fr= 1--      0.7335                 0.6842                 0.7405
  Dep-U Fr= 1--      0.8463                 0.8125                 0.8509
 Alpha2 Fr= 1--      0.0105                 0.0753                 0.0118
 Beta2  Fr= 1--      5.2385                 8.8150                10.3929
 AlphaG Fr= 1--     -0.0640                -0.1090                -0.0898
 Gamma2 Fr= 1--    -15.2794               -17.3033                16.1986
 Delta2 Fr= 1--      2.0545                -4.6576                 8.7399
 Raman1 Fr= 1--     148.561                260.383                293.135
 ROA1   Fr= 1--   -1401.077              -1810.161               1834.740
 CID1   Fr= 1--      -9.431                 -6.952                  6.259
 Raman2 Fr= 1--      62.862                105.780                124.715
 ROA2   Fr= 1--    -383.141               -378.019                318.846
 CID2   Fr= 1--      -6.095                 -3.574                  2.557
 Raman3 Fr= 1--     125.723                211.560                249.431
 ROA3   Fr= 1--   -1401.077              -1810.161               1834.740
 CID3   Fr= 1--     -11.144                 -8.556                  7.356
 RC180  Fr= 1--       0.693                  0.625                  0.702
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.00     0.00   0.00   0.00     0.00   0.00   0.00
     2   6    -0.00   0.00   0.00    -0.00  -0.00   0.00    -0.00   0.00  -0.00
     3   6     0.02  -0.01  -0.00    -0.00   0.00   0.00     0.02  -0.01  -0.00
     4   6     0.03  -0.01  -0.01     0.01  -0.00  -0.00     0.02  -0.01  -0.00
     5   6    -0.00  -0.00  -0.00     0.00   0.00   0.00     0.00   0.00   0.00
     6   6    -0.00   0.00  -0.00    -0.00  -0.00  -0.00    -0.00  -0.00   0.00
     7   6    -0.02   0.05  -0.06     0.00  -0.01   0.02     0.00  -0.00   0.00
     8   6    -0.01  -0.00   0.02    -0.08  -0.01   0.04    -0.04   0.03  -0.07
     9   8    -0.00   0.00   0.00     0.00   0.00   0.00     0.00   0.00   0.00
    10   6     0.00  -0.00   0.01     0.00   0.01   0.01     0.00  -0.00   0.01
    11   6    -0.03   0.01   0.01     0.01  -0.01  -0.01     0.01   0.01   0.00
    12   1    -0.10   0.06   0.12     0.01  -0.00  -0.01    -0.08   0.05   0.10
    13   1    -0.18   0.05  -0.09     0.01  -0.00   0.01    -0.11   0.03  -0.06
    14   1    -0.09   0.15  -0.01    -0.03   0.05  -0.01    -0.08   0.13  -0.01
    15   1    -0.22  -0.05   0.08    -0.07  -0.01   0.02    -0.16  -0.03   0.06
    16   1    -0.06  -0.10   0.59     0.02   0.03  -0.18     0.00   0.00  -0.01
    17   1     0.26  -0.45   0.10    -0.08   0.14  -0.03    -0.01   0.02  -0.01
    18   1     0.05   0.04   0.05    -0.03  -0.02  -0.03    -0.02  -0.01  -0.01
    19   1     0.02  -0.00   0.02     0.32   0.00   0.24     0.58   0.01   0.38
    20   1     0.02   0.11  -0.12     0.05   0.32  -0.36    -0.09  -0.41   0.47
    21   1     0.13  -0.05  -0.09     0.55  -0.22  -0.40    -0.00   0.00  -0.02
    22   1     0.01   0.04  -0.08     0.00   0.01  -0.02     0.01   0.03  -0.06
    23   1     0.00  -0.02  -0.00     0.01  -0.08  -0.01    -0.00   0.01   0.00
    24   1    -0.03  -0.01  -0.03    -0.04  -0.02  -0.04    -0.02  -0.01  -0.02
    25   1     0.28  -0.02  -0.13    -0.08   0.00   0.03    -0.06   0.01   0.03
    26   1     0.07   0.04   0.08     0.01   0.00   0.01    -0.06  -0.03  -0.06
    27   1     0.01  -0.11  -0.02    -0.02   0.11   0.02     0.02  -0.07  -0.01
                     73                     74                     75
                      A                      A                      A
 Frequencies --   3105.3045              3113.1033              3127.4724
 Red. masses --      1.1041                 1.0986                 1.0960
 Frc consts  --      6.2730                 6.2728                 6.3158
 IR Inten    --     70.7487                20.2371                26.3282
 RamAct Fr= 1--     73.6456                49.4672                52.7989
  Dep-P Fr= 1--      0.7388                 0.6510                 0.5407
  Dep-U Fr= 1--      0.8498                 0.7886                 0.7019
 Alpha2 Fr= 1--      0.0141                 0.0879                 0.2125
 Beta2  Fr= 1--     10.4301                 6.5016                 6.1768
 AlphaG Fr= 1--     -0.0408                -0.1722                -0.1438
 Gamma2 Fr= 1--    -12.8074                23.2175                -2.7749
 Delta2 Fr= 1--     -7.1651                 6.7311                 0.3471
 Raman1 Fr= 1--     294.583                197.869                211.196
 ROA1   Fr= 1--   -1458.796               2444.273               -255.285
 CID1   Fr= 1--      -4.952                 12.353                 -1.209
 Raman2 Fr= 1--     125.161                 78.019                 74.122
 ROA2   Fr= 1--    -250.058                503.371                -69.375
 CID2   Fr= 1--      -1.998                  6.452                 -0.936
 Raman3 Fr= 1--     250.323                156.039                148.243
 ROA3   Fr= 1--   -1458.796               2444.273               -255.285
 CID3   Fr= 1--      -5.828                 15.665                 -1.722
 RC180  Fr= 1--       0.700                  0.577                  0.404
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00   0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
     2   6    -0.00   0.00  -0.00     0.00  -0.00   0.00     0.00  -0.00  -0.00
     3   6    -0.04   0.02   0.01    -0.00   0.00   0.00     0.01  -0.00  -0.00
     4   6    -0.06   0.02   0.01    -0.00  -0.00  -0.00     0.01  -0.00  -0.00
     5   6    -0.01  -0.00  -0.01     0.00   0.00   0.00     0.00   0.00   0.00
     6   6    -0.00   0.00  -0.00     0.00  -0.00   0.00     0.00  -0.00   0.00
     7   6    -0.01   0.02  -0.02     0.00  -0.02   0.03    -0.00   0.00  -0.00
     8   6    -0.03   0.01  -0.01    -0.00   0.00  -0.00    -0.00   0.00  -0.00
     9   8     0.00  -0.00   0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
    10   6    -0.00   0.01  -0.01     0.00  -0.00   0.00    -0.00   0.05  -0.07
    11   6    -0.01   0.01   0.00    -0.08   0.02   0.02    -0.00   0.00   0.00
    12   1     0.21  -0.12  -0.24     0.00  -0.00  -0.01    -0.06   0.04   0.07
    13   1     0.32  -0.10   0.17     0.01  -0.00   0.00    -0.05   0.01  -0.02
    14   1     0.22  -0.36   0.04    -0.00   0.00  -0.00    -0.03   0.05  -0.01
    15   1     0.47   0.10  -0.17     0.00   0.00  -0.00    -0.14  -0.03   0.05
    16   1    -0.03  -0.04   0.24     0.03   0.06  -0.34    -0.00  -0.00   0.00
    17   1     0.12  -0.20   0.05    -0.09   0.16  -0.04     0.00  -0.00   0.00
    18   1     0.08   0.06   0.08    -0.02  -0.01  -0.01    -0.01  -0.00  -0.01
    19   1     0.24   0.01   0.16     0.02   0.00   0.02     0.01   0.00   0.01
    20   1    -0.02  -0.08   0.09    -0.00  -0.02   0.02    -0.00  -0.01   0.01
    21   1     0.11  -0.04  -0.09     0.01  -0.00  -0.01     0.00  -0.00  -0.00
    22   1    -0.02  -0.06   0.12     0.00   0.01  -0.02    -0.12  -0.43   0.80
    23   1     0.01  -0.08  -0.02     0.00  -0.01  -0.00     0.03  -0.25  -0.06
    24   1     0.02   0.01   0.01    -0.00  -0.00  -0.00     0.14   0.07   0.11
    25   1     0.10  -0.01  -0.05     0.75  -0.05  -0.35     0.01  -0.00  -0.01
    26   1     0.01   0.01   0.01     0.15   0.09   0.17    -0.00   0.00   0.00
    27   1     0.01  -0.08  -0.01     0.04  -0.28  -0.05     0.00  -0.02  -0.00

 -------------------
 - Thermochemistry -
 -------------------
 Temperature   298.150 Kelvin.  Pressure   1.00000 Atm.
 Atom     1 has atomic number  6 and mass  12.00000
 Atom     2 has atomic number  6 and mass  12.00000
 Atom     3 has atomic number  6 and mass  12.00000
 Atom     4 has atomic number  6 and mass  12.00000
 Atom     5 has atomic number  6 and mass  12.00000
 Atom     6 has atomic number  6 and mass  12.00000
 Atom     7 has atomic number  6 and mass  12.00000
 Atom     8 has atomic number  6 and mass  12.00000
 Atom     9 has atomic number  8 and mass  15.99491
 Atom    10 has atomic number  6 and mass  12.00000
 Atom    11 has atomic number  6 and mass  12.00000
 Atom    12 has atomic number  1 and mass   1.00783
 Atom    13 has atomic number  1 and mass   1.00783
 Atom    14 has atomic number  1 and mass   1.00783
 Atom    15 has atomic number  1 and mass   1.00783
 Atom    16 has atomic number  1 and mass   1.00783
 Atom    17 has atomic number  1 and mass   1.00783
 Atom    18 has atomic number  1 and mass   1.00783
 Atom    19 has atomic number  1 and mass   1.00783
 Atom    20 has atomic number  1 and mass   1.00783
 Atom    21 has atomic number  1 and mass   1.00783
 Atom    22 has atomic number  1 and mass   1.00783
 Atom    23 has atomic number  1 and mass   1.00783
 Atom    24 has atomic number  1 and mass   1.00783
 Atom    25 has atomic number  1 and mass   1.00783
 Atom    26 has atomic number  1 and mass   1.00783
 Atom    27 has atomic number  1 and mass   1.00783
 Molecular mass:   152.12012 amu.
 Principal axes and moments of inertia in atomic units:
                           1         2         3
     Eigenvalues --  1242.481721522.918951641.96827
           X            0.99901  -0.04146   0.01640
           Y            0.04144   0.99914   0.00175
           Z           -0.01646  -0.00107   0.99986
 This molecule is an asymmetric top.
 Rotational symmetry number  1.
 Warning -- assumption of classical behavior for rotation
           may cause significant error
 Rotational temperatures (Kelvin)      0.06971     0.05687     0.05275
 Rotational constants (GHZ):           1.45253     1.18505     1.09913
 Zero-point vibrational energy     632116.4 (Joules/Mol)
                                  151.07944 (Kcal/Mol)
 Warning -- explicit consideration of  17 degrees of freedom as
           vibrations may cause significant error
 Vibrational temperatures:    155.18   242.92   263.98   312.66   323.48
          (Kelvin)            347.99   377.51   417.28   432.82   553.53
                              568.47   598.46   685.53   755.38   806.66
                              829.03   891.38   938.85  1027.76  1087.79
                             1203.12  1241.97  1256.91  1333.29  1358.61
                             1363.64  1381.63  1390.23  1443.05  1485.56
                             1495.93  1521.38  1585.82  1612.14  1655.56
                             1688.21  1715.00  1753.43  1767.28  1796.29
                             1824.67  1835.19  1874.14  1911.03  1921.81
                             1942.56  2028.05  2038.17  2058.89  2103.97
                             2137.32  2143.10  2149.13  2156.68  2164.20
                             2177.81  2185.00  2197.61  2614.30  4364.73
                             4369.99  4374.54  4398.12  4407.21  4410.33
                             4437.70  4437.96  4442.78  4448.31  4458.01
                             4460.94  4465.67  4467.84  4479.06  4499.74
 
 Zero-point correction=                           0.240760 (Hartree/Particle)
 Thermal correction to Energy=                    0.251431
 Thermal correction to Enthalpy=                  0.252375
 Thermal correction to Gibbs Free Energy=         0.206095
 Sum of electronic and zero-point Energies=           -465.910956
 Sum of electronic and thermal Energies=              -465.900285
 Sum of electronic and thermal Enthalpies=            -465.899341
 Sum of electronic and thermal Free Energies=         -465.945621
 
                     E (Thermal)             CV                S
                      KCal/Mol        Cal/Mol-Kelvin    Cal/Mol-Kelvin
 Total                  157.775             43.574             97.405
 Electronic               0.000              0.000              0.000
 Translational            0.889              2.981             40.968
 Rotational               0.889              2.981             29.520
 Vibrational            155.998             37.612             26.916
 Vibration     1          0.606              1.943              3.307
 Vibration     2          0.625              1.881              2.448
 Vibration     3          0.631              1.862              2.293
 Vibration     4          0.646              1.815              1.981
 Vibration     5          0.649              1.803              1.920
 Vibration     6          0.658              1.776              1.789
 Vibration     7          0.670              1.742              1.646
 Vibration     8          0.686              1.692              1.474
 Vibration     9          0.693              1.672              1.412
 Vibration    10          0.754              1.503              1.021
 Vibration    11          0.762              1.481              0.981
 Vibration    12          0.779              1.436              0.906
 Vibration    13          0.833              1.302              0.720
 Vibration    14          0.880              1.195              0.598
 Vibration    15          0.916              1.116              0.523
 Vibration    16          0.933              1.083              0.492
 Vibration    17          0.980              0.991              0.417
                       Q            Log10(Q)             Ln(Q)
 Total Bot       0.159586D-94        -94.797004       -218.278169
 Total V=0       0.881043D+16         15.944997         36.714712
 Vib (Bot)       0.342966-108       -108.464749       -249.749315
 Vib (Bot)    1  0.189984D+01          0.278717          0.641769
 Vib (Bot)    2  0.119403D+01          0.077016          0.177336
 Vib (Bot)    3  0.109338D+01          0.038772          0.089276
 Vib (Bot)    4  0.911256D+00         -0.040360         -0.092932
 Vib (Bot)    5  0.877989D+00         -0.056511         -0.130121
 Vib (Bot)    6  0.810022D+00         -0.091503         -0.210693
 Vib (Bot)    7  0.739388D+00         -0.131128         -0.301933
 Vib (Bot)    8  0.659368D+00         -0.180872         -0.416473
 Vib (Bot)    9  0.631893D+00         -0.199357         -0.459036
 Vib (Bot)   10  0.468405D+00         -0.329379         -0.758423
 Vib (Bot)   11  0.452715D+00         -0.344175         -0.792492
 Vib (Bot)   12  0.423442D+00         -0.373207         -0.859340
 Vib (Bot)   13  0.352075D+00         -0.453365         -1.043912
 Vib (Bot)   14  0.306028D+00         -0.514239         -1.184079
 Vib (Bot)   15  0.277035D+00         -0.557466         -1.283612
 Vib (Bot)   16  0.265463D+00         -0.575996         -1.326279
 Vib (Bot)   17  0.236160D+00         -0.626794         -1.443248
 Vib (V=0)       0.189344D+03          2.277252          5.243566
 Vib (V=0)    1  0.246453D+01          0.391734          0.902002
 Vib (V=0)    2  0.179449D+01          0.253942          0.584722
 Vib (V=0)    3  0.170228D+01          0.231032          0.531971
 Vib (V=0)    4  0.153942D+01          0.187356          0.431404
 Vib (V=0)    5  0.151038D+01          0.179086          0.412360
 Vib (V=0)    6  0.145191D+01          0.161940          0.372881
 Vib (V=0)    7  0.139258D+01          0.143819          0.331156
 Vib (V=0)    8  0.132751D+01          0.123037          0.283302
 Vib (V=0)    9  0.130578D+01          0.115871          0.266804
 Vib (V=0)   10  0.118513D+01          0.073766          0.169852
 Vib (V=0)   11  0.117450D+01          0.069853          0.160843
 Vib (V=0)   12  0.115521D+01          0.062662          0.144284
 Vib (V=0)   13  0.111152D+01          0.045917          0.105728
 Vib (V=0)   14  0.108622D+01          0.035918          0.082703
 Vib (V=0)   15  0.107162D+01          0.030040          0.069171
 Vib (V=0)   16  0.106610D+01          0.027798          0.064008
 Vib (V=0)   17  0.105297D+01          0.022414          0.051611
 Electronic      0.100000D+01          0.000000          0.000000
 Translational   0.737452D+08          7.867734         18.116127
 Rotational      0.630974D+06          5.800011         13.355020
 ***** Axes restored to original set *****
 -------------------------------------------------------------------
 Center     Atomic                   Forces (Hartrees/Bohr)
 Number     Number              X              Y              Z
 -------------------------------------------------------------------
      1        6          -0.000053041   -0.000024740    0.000009116
      2        6           0.000038176    0.000017183   -0.000001880
      3        6          -0.000044485   -0.000008475    0.000029904
      4        6           0.000003597   -0.000017072   -0.000001263
      5        6           0.000019569   -0.000009345   -0.000013874
      6        6          -0.000009171   -0.000018880    0.000019534
      7        6          -0.000024798    0.000021183    0.000020197
      8        6          -0.000007845    0.000002301   -0.000004714
      9        8           0.000001964   -0.000000422    0.000001435
     10        6           0.000036290    0.000028404   -0.000012594
     11        6           0.000009774   -0.000012449   -0.000010072
     12        1          -0.000017893    0.000010456   -0.000002245
     13        1          -0.000000444    0.000000879    0.000001683
     14        1          -0.000002233   -0.000003836    0.000009747
     15        1           0.000015139   -0.000008782   -0.000005708
     16        1           0.000004858    0.000007463   -0.000007006
     17        1          -0.000000158    0.000002355   -0.000001628
     18        1           0.000002348    0.000003374    0.000001667
     19        1           0.000001018    0.000000757   -0.000001537
     20        1           0.000002679   -0.000002031    0.000006031
     21        1           0.000003668   -0.000001781    0.000002187
     22        1          -0.000003981    0.000030162   -0.000010172
     23        1           0.000012706   -0.000007611   -0.000008590
     24        1          -0.000006746    0.000000813    0.000002245
     25        1           0.000018156   -0.000015419   -0.000011765
     26        1           0.000000227    0.000001199   -0.000004221
     27        1           0.000000626    0.000004314   -0.000006479
 -------------------------------------------------------------------
 Cartesian Forces:  Max     0.000053041 RMS     0.000014691
 End of FrcOut F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.121488D+03  0.100203D+01 -0.265460D+00
      2   0.100203D+01  0.116779D+03  0.153747D+01
      3  -0.265460D+00  0.153747D+01  0.112986D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1   0.353882D-01 -0.440360D+01  0.230893D+01
      2   0.211408D+01 -0.464285D+01  0.212555D+02
      3   0.470251D+01 -0.171946D+02  0.524943D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1   0.259452D+02 -0.134841D+02  0.116965D+02
      2  -0.164690D+02  0.623101D+01 -0.862976D+01
      3  -0.947621D+01  0.725312D+01 -0.306671D+01
      4  -0.181576D+02  0.336086D+02 -0.178955D+02
      5   0.868593D+01 -0.180472D+02  0.434177D+02
      6  -0.109234D+02 -0.142850D+02 -0.512681D+01
 End of FrcOut F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    81 ND12= 1 LenFil=    2919:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.180770D+01  0.138670D+01  0.527430D+01  0.887093D+00  0.242698D+01
      2   0.138670D+01  0.272765D+01  0.330987D+00  0.242698D+01 -0.551383D+01
      3   0.527430D+01  0.330987D+00  0.273494D+01  0.241642D-01 -0.137066D+01
                 6             7             8             9            10 
      1   0.241642D-01  0.628433D+01  0.543057D+00  0.200773D+01 -0.408498D+01
      2  -0.137066D+01  0.543057D+00 -0.136212D+01  0.370741D+01 -0.192719D+01
      3   0.288449D+01  0.200773D+01  0.370741D+01 -0.807982D+00 -0.397765D+01
                11            12            13            14            15 
      1  -0.192719D+01 -0.397765D+01 -0.240438D+01  0.649674D+00  0.196174D+01
      2   0.897520D+00  0.201736D+01  0.649674D+00  0.341565D+00  0.262577D+01
      3   0.201736D+01 -0.627517D+00  0.196174D+01  0.262577D+01 -0.357589D+01
                16            17            18            19            20 
      1  -0.391003D+01  0.195175D+01 -0.187998D+01  0.221608D+01 -0.331609D+00
      2   0.195175D+01  0.206046D+01 -0.262728D+01 -0.331609D+00 -0.121825D+01
      3  -0.187998D+01 -0.262728D+01 -0.174760D+01  0.404211D+01 -0.249650D+01
                21            22            23            24            25 
      1   0.404211D+01  0.559608D+00 -0.208704D+00 -0.347295D+01  0.271339D+01
      2  -0.249650D+01 -0.208704D+00  0.574004D+00 -0.214665D+01 -0.222048D+01
      3  -0.649859D+00 -0.347295D+01 -0.214665D+01  0.214333D+01 -0.208393D+00
                26            27            28            29            30 
      1  -0.222048D+01 -0.208393D+00 -0.368190D+01 -0.237563D+01  0.225023D+01
      2  -0.282560D+01  0.148324D+01 -0.237563D+01  0.364326D+01  0.873220D+00
      3   0.148324D+01  0.237826D+01  0.225023D+01  0.873220D+00 -0.264800D+00
                31            32            33            34            35 
      1  -0.946313D+00  0.287687D+01  0.887783D+00  0.184530D+01  0.937942D+00
      2   0.287687D+01 -0.342058D+01  0.179032D+01  0.937942D+00  0.145500D+01
      3   0.887783D+00  0.179032D+01  0.168262D+01 -0.764108D-01  0.143692D+01
                36            37            38            39            40 
      1  -0.764108D-01  0.735268D+00 -0.106744D+01 -0.378273D+01  0.132315D+00
      2   0.143692D+01 -0.106744D+01 -0.302486D+01 -0.146541D+01 -0.400419D+01
      3  -0.246652D+01 -0.378273D+01 -0.146541D+01 -0.166323D+01 -0.172866D+01
                41            42            43            44            45 
      1  -0.400419D+01 -0.172866D+01 -0.308769D+01 -0.150231D+01 -0.176746D+01
      2   0.450541D+01 -0.146257D+01 -0.150231D+01 -0.305673D+00 -0.328367D+01
      3  -0.146257D+01 -0.243217D+01 -0.176746D+01 -0.328367D+01  0.166639D+01
                46            47            48            49            50 
      1   0.746509D+01  0.300187D+01  0.134811D+00  0.283210D+01 -0.104708D+01
      2   0.300187D+01 -0.335833D+01 -0.279409D+01 -0.104708D+01 -0.635104D+00
      3   0.134811D+00 -0.279409D+01 -0.187634D+01 -0.173674D+01 -0.796582D+00
                51            52            53            54            55 
      1  -0.173674D+01  0.264402D+00 -0.126576D+01  0.150096D+00 -0.110759D+01
      2  -0.796582D+00 -0.126576D+01 -0.442870D+00  0.480985D+00 -0.985148D+00
      3   0.203670D+00  0.150096D+00  0.480985D+00  0.171970D+01  0.120701D+01
                56            57            58            59            60 
      1  -0.985148D+00  0.120701D+01 -0.148093D+01  0.345888D+01  0.941362D+00
      2   0.457479D+01  0.131445D+01  0.345888D+01 -0.290134D+01  0.130598D+01
      3   0.131445D+01  0.141788D+01  0.941362D+00  0.130598D+01  0.185569D+01
                61            62            63            64            65 
      1   0.258164D+00 -0.436330D+00  0.111607D+01  0.149314D+01  0.193307D+01
      2  -0.436330D+00  0.164751D+01  0.636736D+00  0.193307D+01 -0.222830D+00
      3   0.111607D+01  0.636736D+00 -0.532414D+01  0.459794D+01 -0.120324D+01
                66            67            68            69            70 
      1   0.459794D+01  0.142426D+01 -0.682511D+00 -0.123935D+01  0.387054D+01
      2  -0.120324D+01 -0.682511D+00 -0.394420D-01 -0.272653D+01 -0.138438D+01
      3   0.969352D+00 -0.123935D+01 -0.272653D+01  0.250862D+01  0.844461D+00
                71            72            73            74            75 
      1  -0.138438D+01  0.844461D+00 -0.159708D+02 -0.301136D+01  0.104505D+01
      2  -0.274136D+01  0.293496D+01 -0.301136D+01 -0.112834D+01  0.809520D+00
      3   0.293496D+01  0.770290D+00  0.104505D+01  0.809520D+00 -0.938323D+00
                76            77            78            79            80 
      1  -0.326335D+01 -0.336973D+01  0.579340D+00  0.343761D+00  0.243581D+00
      2  -0.336973D+01 -0.205211D+01  0.585965D+00  0.243581D+00  0.135559D+00
      3   0.579340D+00  0.585965D+00 -0.386101D+00 -0.297214D+01 -0.846724D+00
                81            82            83            84            85 
      1  -0.297214D+01 -0.112613D+01 -0.167412D+01 -0.410371D+01 -0.208117D+01
      2  -0.846724D+00 -0.167412D+01 -0.146357D+01 -0.286513D+00 -0.215380D+01
      3  -0.265457D-02 -0.410371D+01 -0.286513D+00 -0.192094D+01 -0.413513D+00
                86            87            88            89            90 
      1  -0.215380D+01 -0.413513D+00 -0.478796D+01 -0.425560D+00 -0.229018D+01
      2   0.529991D+01  0.169294D+01 -0.425560D+00  0.164021D+01 -0.262607D+01
      3   0.169294D+01 -0.270093D+01 -0.229018D+01 -0.262607D+01  0.225387D+01
                91            92            93            94            95 
      1   0.171258D+01 -0.549562D+00 -0.466542D+01 -0.796548D+00 -0.175982D+01
      2  -0.549562D+00 -0.156818D+01 -0.609763D+00 -0.175982D+01  0.536763D+01
      3  -0.466542D+01 -0.609763D+00 -0.187079D+01 -0.859190D+00  0.108956D+01
                96            97            98            99           100 
      1  -0.859190D+00 -0.436663D+01 -0.780950D+00 -0.177496D+01  0.220775D+01
      2   0.108956D+01 -0.780950D+00  0.178137D+01 -0.262813D+01 -0.332444D+00
      3  -0.308676D+01 -0.177496D+01 -0.262813D+01 -0.572860D+00 -0.222306D+01
               101           102           103           104           105 
      1  -0.332444D+00 -0.222306D+01 -0.948497D+00  0.633901D+00  0.121181D+01
      2   0.117034D+01  0.634474D+00  0.633901D+00 -0.110745D+01 -0.952070D+00
      3   0.634474D+00  0.326963D+01  0.121181D+01 -0.952070D+00 -0.246827D+01
               106           107           108           109           110 
      1  -0.178755D+01  0.445751D+00  0.200426D+01 -0.440109D+01  0.975553D+00
      2   0.445751D+00 -0.903728D+00 -0.969970D+00  0.975553D+00 -0.143620D+01
      3   0.200426D+01 -0.969970D+00 -0.632875D+01 -0.338005D+01  0.125391D+01
               111           112           113           114           115 
      1  -0.338005D+01  0.836029D+00 -0.908925D+00  0.826446D+00 -0.201278D+01
      2   0.125391D+01 -0.908925D+00  0.987919D+00 -0.899719D+00  0.728537D+00
      3  -0.376260D+01  0.826446D+00 -0.899719D+00  0.844685D+00 -0.200494D+01
               116           117           118           119           120 
      1   0.728537D+00 -0.200494D+01 -0.957226D+00  0.197268D+01 -0.611073D+00
      2  -0.643023D+00  0.685759D+00  0.197268D+01 -0.379278D+01  0.709852D+00
      3   0.685759D+00 -0.378795D+01 -0.611073D+00  0.709852D+00 -0.896555D+00
               121           122           123           124           125 
      1   0.149992D+01 -0.180356D+01  0.238157D+00 -0.324920D+00  0.416312D-01
      2  -0.180356D+01  0.880849D+01 -0.169080D+01  0.416312D-01 -0.807716D+00
      3   0.238157D+00 -0.169080D+01  0.132043D+01 -0.399598D+00  0.104652D+01
               126           127           128           129           130 
      1  -0.399598D+00  0.636885D+01  0.273227D+01 -0.210907D+01  0.146152D+01
      2   0.104652D+01  0.273227D+01  0.250861D+01 -0.122039D+01  0.136065D+01
      3  -0.388119D+00 -0.210907D+01 -0.122039D+01  0.199838D+01 -0.652494D+00
               131           132           133           134           135 
      1   0.136065D+01 -0.652494D+00 -0.181131D+01 -0.867857D+00  0.147060D+01
      2   0.196394D+01 -0.831224D+00 -0.867857D+00 -0.108325D+01  0.735013D+00
      3  -0.831224D+00  0.401790D+00  0.147060D+01  0.735013D+00 -0.133838D+01
               136           137           138           139           140 
      1  -0.277657D+00  0.188217D+00  0.124910D+01 -0.344482D+00 -0.371117D+00
      2   0.188217D+00 -0.672548D+00 -0.411208D+00 -0.371117D+00  0.326186D+00
      3   0.124910D+01 -0.411208D+00 -0.135220D+01  0.198028D+00  0.799001D+00
               141           142           143           144           145 
      1   0.198028D+00  0.169837D+01 -0.222541D+00 -0.147488D+01 -0.276682D+01
      2   0.799001D+00 -0.222541D+00  0.147863D+01  0.106267D+01  0.264598D+01
      3  -0.924022D+00 -0.147488D+01  0.106267D+01  0.901862D+01  0.258502D+00
               146           147           148           149           150 
      1   0.264598D+01  0.258502D+00  0.277180D+01 -0.302555D+01 -0.481023D+00
      2  -0.361739D+01 -0.742461D+00 -0.302555D+01  0.727583D+01  0.509034D+00
      3  -0.742461D+00 -0.848763D+00 -0.481023D+00  0.509034D+00  0.106980D+01
               151           152           153           154           155 
      1  -0.812385D+00  0.566901D+00 -0.397163D+00  0.374216D+01  0.235720D+01
      2   0.566901D+00 -0.114041D+01  0.899813D+00  0.235720D+01  0.266549D+01
      3  -0.397163D+00  0.899813D+00  0.604968D+00  0.251347D+01  0.145450D+01
               156           157           158           159           160 
      1   0.251347D+01  0.148363D+01  0.211092D+01  0.909286D+00  0.240661D+01
      2   0.145450D+01  0.211092D+01  0.298487D+01  0.183570D+01  0.136656D+01
      3   0.237844D+01  0.909286D+00  0.183570D+01  0.186112D+01  0.219315D+01
               161           162           163           164           165 
      1   0.136656D+01  0.219315D+01 -0.483802D+01 -0.176106D+01 -0.321235D+01
      2   0.215470D+01  0.240756D+01 -0.176106D+01 -0.218977D+01 -0.120483D+01
      3   0.240756D+01  0.352253D+01 -0.321235D+01 -0.120483D+01 -0.315363D+01
               166           167           168           169           170 
      1  -0.530678D+00 -0.883917D+00 -0.163799D+00 -0.288084D+01 -0.778305D+00
      2  -0.883917D+00 -0.491136D+00 -0.391477D+00 -0.778305D+00 -0.989430D+00
      3  -0.163799D+00 -0.391477D+00 -0.355243D+00 -0.237888D+01 -0.150688D+01
               171           172           173           174           175 
      1  -0.237888D+01 -0.704588D+00 -0.110012D+01  0.705840D-02 -0.997098D+00
      2  -0.150688D+01 -0.110012D+01 -0.965471D+00  0.417914D+00 -0.826021D+00
      3  -0.337622D+01  0.705840D-02  0.417914D+00 -0.439568D+00  0.302863D+00
               176           177           178           179           180 
      1  -0.826021D+00  0.302863D+00  0.666269D+00  0.819522D+00 -0.296508D+00
      2  -0.550186D+01  0.194521D+01  0.819522D+00  0.414906D+01 -0.189947D+01
      3   0.194521D+01 -0.178718D+01 -0.296508D+00 -0.189947D+01  0.261986D+01
               181           182           183           184           185 
      1   0.291610D+01 -0.152932D+01 -0.205706D+01 -0.986860D+00  0.123986D+01
      2  -0.152932D+01  0.272585D+01  0.167298D+01  0.123986D+01 -0.196018D+01
      3  -0.205706D+01  0.167298D+01  0.241324D+01  0.804395D+00 -0.940644D+00
               186           187           188           189           190 
      1   0.804395D+00 -0.199453D+01  0.979981D+00  0.136774D+01  0.104332D+01
      2  -0.940644D+00  0.979981D+00 -0.171512D+01 -0.205219D+01  0.751401D+00
      3  -0.124796D+01  0.136774D+01 -0.205219D+01 -0.320391D+01 -0.914459D+00
               191           192           193           194           195 
      1   0.751401D+00 -0.914459D+00  0.164143D+01  0.398701D+00 -0.437534D+00
      2   0.334901D+00 -0.249002D+00  0.398701D+00  0.891893D+00 -0.128924D+01
      3  -0.249002D+00  0.129775D+01 -0.437534D+00 -0.128924D+01  0.180635D+01
               196           197           198           199           200 
      1  -0.221087D+01 -0.102881D+00  0.188759D+01  0.127898D+01 -0.115242D+01
      2  -0.102881D+00 -0.167436D+01  0.150165D+01 -0.115242D+01  0.114516D+01
      3   0.188759D+01  0.150165D+01 -0.486881D+01  0.440025D-01  0.242964D+00
               201           202           203           204           205 
      1   0.440025D-01 -0.296307D+01  0.278198D+01  0.558795D+00  0.434164D-01
      2   0.242964D+00  0.278198D+01 -0.714600D+01 -0.114425D+01  0.382266D+00
      3   0.382713D+00  0.558795D+00 -0.114425D+01 -0.116902D+01  0.716015D+00
               206           207           208           209           210 
      1   0.382266D+00  0.716015D+00  0.721538D+01  0.797978D+00  0.248039D+01
      2  -0.975335D+00 -0.765000D+00  0.797978D+00  0.108532D+01  0.229303D+00
      3  -0.765000D+00 -0.708692D+00  0.248039D+01  0.229303D+00  0.177125D+01
               211           212           213           214           215 
      1   0.234349D+01  0.135564D+01  0.681438D+00  0.496798D+01  0.339817D+00
      2   0.135564D+01  0.212033D+00  0.352128D+00  0.339817D+00  0.768183D+00
      3   0.681438D+00  0.352128D+00  0.904727D+00  0.244964D+01  0.557534D+00
               216           217           218           219           220 
      1   0.244964D+01 -0.435654D+01  0.195326D-01  0.212393D+01  0.148886D+00
      2   0.557534D+00  0.195326D-01 -0.135244D+01  0.937766D+00 -0.613084D+00
      3   0.212422D+01  0.212393D+01  0.937766D+00 -0.293405D+01  0.355447D+00
               221           222           223           224           225 
      1  -0.613084D+00  0.355447D+00  0.192472D+01  0.312165D+00 -0.146089D+01
      2  -0.532472D+00  0.288950D+00  0.312165D+00  0.436906D+00 -0.184153D+00
      3   0.288950D+00  0.222681D+00 -0.146089D+01 -0.184153D+00  0.274937D+01
               226           227           228           229           230 
      1   0.344664D+01  0.134655D+00  0.323131D+01  0.116236D+01  0.774294D+00
      2   0.134655D+00  0.113127D+01 -0.359506D-01  0.774294D+00  0.997838D-01
      3   0.323131D+01 -0.359506D-01  0.399803D+01  0.971829D+00  0.636303D+00
               231           232           233           234           235 
      1   0.971829D+00  0.261542D+01  0.103219D+00  0.291818D+01  0.624325D+00
      2   0.636303D+00  0.103219D+00  0.678705D+00  0.302641D+00 -0.109971D+01
      3   0.202645D+01  0.291818D+01  0.302641D+00  0.567281D+01  0.577409D+00
               236           237           238           239           240 
      1  -0.109971D+01  0.577409D+00 -0.144107D+01  0.158963D+01 -0.267628D+00
      2   0.140079D+01 -0.179837D+00  0.158963D+01 -0.833794D+01  0.118555D+01
      3  -0.179837D+00  0.567568D+00 -0.267628D+00  0.118555D+01 -0.160290D+01
               241           242           243 
      1   0.848095D-01  0.224660D+00  0.256839D+00
      2   0.224660D+00 -0.776295D+00 -0.489868D+00
      3   0.256839D+00 -0.489868D+00 -0.178304D+00
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.125205D+01  0.971306D+00  0.161888D+01  0.225265D+01 -0.549836D+01
      2   0.858888D+01 -0.167174D+00  0.373014D+01  0.161522D+01 -0.398631D+01
      3   0.931674D+00 -0.652423D+01 -0.185020D+01  0.102417D+01  0.681453D+01
                 6             7             8             9            10 
      1  -0.353965D+01  0.406732D+01  0.370465D+01  0.167660D+01 -0.422595D+01
      2   0.273798D+01 -0.307355D+01  0.305740D+01 -0.251092D+01 -0.202042D+01
      3   0.263399D+01 -0.215701D+01  0.276028D+01 -0.324841D+01 -0.223232D+01
                11            12            13            14            15 
      1  -0.266392D+01  0.122045D+01  0.129798D+01  0.446207D+01 -0.106590D+02
      2  -0.324267D+01  0.204823D+01 -0.321488D+01 -0.350709D+00  0.126607D+01
      3  -0.326767D+01  0.370556D+01  0.681718D+01  0.414941D+00  0.124520D+01
                16            17            18            19            20 
      1  -0.514837D+01  0.153896D+00 -0.244786D+01  0.435189D+01  0.410221D+01
      2  -0.595790D+01  0.370690D+01 -0.563581D+01  0.507405D+01 -0.112712D+01
      3   0.335880D+01  0.277599D+01 -0.207002D+00 -0.379604D+00 -0.434789D+01
                21            22            23            24            25 
      1   0.411413D+01 -0.704663D+00  0.163823D+01  0.513154D+01  0.461667D+01
      2   0.112021D+02 -0.755895D+00 -0.657243D+00 -0.766703D+01  0.382944D+01
      3   0.394533D+00  0.578635D+00 -0.209797D+00 -0.155431D+01  0.745782D+00
                26            27            28            29            30 
      1   0.958326D+01 -0.981586D+00 -0.496938D+01 -0.640742D+01 -0.106131D+01
      2  -0.741038D+01  0.664851D+00 -0.211821D+01 -0.188243D+01  0.491759D+01
      3  -0.170395D+01  0.521342D+00 -0.848083D+01 -0.124370D+02  0.581639D+01
                31            32            33            34            35 
      1  -0.579838D+01 -0.199526D+01 -0.104277D+02 -0.370569D+00 -0.483999D+01
      2  -0.533780D+00  0.471155D+01  0.289406D+01  0.565193D+00  0.209445D+01
      3  -0.356170D+01  0.119642D+02  0.529269D+00  0.525537D+01  0.154605D+01
                36            37            38            39            40 
      1   0.608710D+01  0.368079D+01  0.946463D+00  0.508635D+00  0.473237D+00
      2  -0.416181D+01 -0.550262D+01 -0.103288D+01  0.418856D+01 -0.107730D+01
      3  -0.150469D+01  0.489886D+01 -0.251803D+01 -0.374813D+01  0.555319D+01
                41            42            43            44            45 
      1   0.504823D+01  0.863244D+00 -0.604689D+00  0.815171D+01 -0.722647D+01
      2   0.173774D+01 -0.128865D+01 -0.247245D+01 -0.678898D+00  0.310519D+01
      3  -0.895468D+01 -0.152764D+01 -0.328735D+01 -0.167358D+01 -0.386370D+00
                46            47            48            49            50 
      1   0.319375D+01  0.188185D+01  0.481338D+01  0.387395D+01 -0.131871D+02
      2  -0.297425D+01  0.657773D+01 -0.295717D+01  0.564264D+01 -0.324649D+01
      3  -0.261724D+00  0.207419D+01 -0.609038D+01  0.572818D+01  0.242592D+01
                51            52            53            54            55 
      1  -0.162091D+01  0.128868D+01  0.103329D+02  0.140170D+02 -0.480981D+01
      2  -0.997848D+00 -0.105356D+02  0.102130D+01  0.548573D+01  0.232034D+01
      3  -0.225715D+01 -0.654315D+01 -0.263651D+01  0.398034D+00 -0.472045D+01
                56            57            58            59            60 
      1   0.612059D+01 -0.236464D+01  0.461496D+01 -0.533501D+01 -0.605883D+01
      2   0.900865D+00 -0.384658D+01  0.888220D+00 -0.625827D+01 -0.189095D+01
      3   0.351129D+01  0.491769D+01  0.662362D+01  0.114527D+01  0.101965D+01
                61            62            63            64            65 
      1  -0.492507D+00  0.492574D+01  0.112945D+02  0.675022D+01 -0.157793D+01
      2  -0.772379D+01  0.209257D+00  0.770079D+01 -0.215807D+01  0.450092D+01
      3   0.346187D+01 -0.464539D+00  0.270325D+01 -0.188515D+01 -0.907353D+01
                66            67            68            69            70 
      1   0.365315D+01 -0.267019D+01 -0.683106D+01  0.765540D+01  0.293025D+01
      2   0.774136D+01  0.273160D+01  0.189338D+01 -0.393018D+01  0.251100D+01
      3  -0.127592D+02 -0.193541D+01  0.166018D+01  0.806197D+00 -0.104342D+02
                71            72            73            74            75 
      1   0.146190D+02 -0.237634D+01 -0.124676D+00 -0.697558D+00 -0.470859D+01
      2  -0.528988D+01  0.704185D+00  0.341295D+01  0.944506D+00  0.132684D+02
      3  -0.115592D+00  0.872295D-01 -0.313076D+01 -0.145923D+02 -0.360394D+00
                76            77            78            79            80 
      1  -0.264930D+01  0.238382D+01 -0.152171D+01  0.973324D+00 -0.129339D+01
      2  -0.130791D+01  0.285524D+01  0.356701D+01  0.422073D+01  0.502744D+00
      3  -0.304875D+01 -0.761560D+01  0.249159D-01  0.506563D+00  0.686101D+00
                81            82            83            84            85 
      1  -0.510464D+01 -0.222345D+01  0.995061D-01 -0.184658D+01  0.230418D-01
      2  -0.159890D+01 -0.115349D+02 -0.621961D+00 -0.515631D+01 -0.194254D+01
      3  -0.262403D+01  0.562259D+01  0.398035D+01  0.304663D+01  0.117429D+02
                86            87            88            89            90 
      1   0.693506D+00 -0.463523D+01 -0.376445D+01 -0.495470D+00  0.304732D+01
      2   0.552686D+01 -0.792357D+01 -0.125126D+02 -0.721359D+01  0.838225D+01
      3  -0.149363D+02 -0.585623D+01  0.436297D+01 -0.558660D+01  0.976496D+01
                91            92            93            94            95 
      1  -0.858374D+01 -0.418735D+01 -0.361631D+01 -0.605855D+01  0.158495D+02
      2  -0.101051D+02 -0.477500D+00  0.127270D+02 -0.135606D+00  0.485389D+01
      3  -0.293670D+01 -0.858147D-01  0.867997D+01  0.443464D+01 -0.376193D+01
                96            97            98            99           100 
      1  -0.541426D+01 -0.378814D+01  0.270331D+01 -0.860318D+01  0.499069D+00
      2  -0.100612D+01  0.628660D+01 -0.159521D+01  0.273619D+01  0.649260D+01
      3   0.917540D-01  0.709302D+01 -0.131246D+01  0.481908D+01  0.103033D+01
               101           102           103           104           105 
      1  -0.480091D+01 -0.229360D+01 -0.428250D+00  0.404949D+01 -0.178984D+00
      2  -0.145825D+01 -0.296791D+01 -0.269505D+01  0.132693D+01  0.161541D+01
      3  -0.145114D+01 -0.881155D+00  0.727813D+00  0.307145D+00  0.240133D+00
               106           107           108           109           110 
      1  -0.169251D+01  0.522569D+01  0.329674D+01 -0.243174D+00  0.402916D+01
      2  -0.599970D+01  0.140710D+01  0.329986D+01 -0.109501D+02  0.145904D+01
      3  -0.345152D+00  0.135099D+01  0.647285D+00 -0.300595D+01 -0.195130D+01
               111           112           113           114           115 
      1  -0.249772D+00  0.106439D+01 -0.169147D+01 -0.395787D+00  0.143030D+00
      2  -0.403943D+01  0.232487D+01 -0.172580D+01  0.186570D+01 -0.542163D+01
      3  -0.162814D+01  0.147660D+01  0.157561D+00  0.576990D+00 -0.148249D+01
               116           117           118           119           120 
      1   0.190250D+01  0.413845D+00 -0.457232D+00  0.306066D+01  0.306132D+01
      2   0.153123D+01 -0.347154D+01 -0.199542D+01  0.223169D+01  0.872776D-01
      3  -0.544125D+00 -0.135376D+01 -0.492622D+01  0.605756D+01 -0.167469D+01
               121           122           123           124           125 
      1   0.188983D+01 -0.562448D+01 -0.449695D+01  0.998135D+00  0.169324D+00
      2   0.216264D+01 -0.336032D+01  0.467438D+00 -0.141710D+01  0.990858D+00
      3   0.778066D+01 -0.100645D+02  0.142620D+01 -0.912504D+00  0.735459D+00
               126           127           128           129           130 
      1  -0.695630D+00  0.270116D+01 -0.941976D+00 -0.477854D+01  0.198764D+00
      2  -0.263037D+00  0.625348D+01  0.137094D+01  0.189953D+01  0.922570D+00
      3  -0.189280D+01  0.146641D+02  0.113873D+01 -0.362540D+01  0.295336D+01
               131           132           133           134           135 
      1   0.449444D+00 -0.897315D+00 -0.265427D+01  0.135286D+01  0.189435D+01
      2   0.651777D+00  0.209455D+00 -0.217983D+01 -0.452149D+00 -0.281706D+00
      3   0.103927D+01 -0.103193D+01 -0.408727D+01 -0.686437D+00  0.299786D+01
               136           137           138           139           140 
      1  -0.132780D+01  0.368131D+00  0.262104D+01  0.370225D+00 -0.134517D+01
      2  -0.123756D+01  0.643894D+00  0.148304D+01  0.635410D+00 -0.163484D+00
      3   0.299049D+00 -0.206741D+01  0.764808D+00 -0.278882D-01 -0.133001D+01
               141           142           143           144           145 
      1   0.370383D+01  0.254414D+01  0.173853D+01 -0.170353D+02  0.334843D+01
      2   0.222865D+01 -0.319545D+01 -0.100766D+01 -0.993325D+01  0.334559D+01
      3   0.951678D+00  0.253285D+01  0.192807D+01 -0.249078D+01 -0.117094D+01
               146           147           148           149           150 
      1  -0.658631D+01  0.211092D+00 -0.399989D+01  0.109488D+02 -0.256666D+01
      2  -0.344280D+01  0.222298D+01 -0.385622D+01  0.531537D+01 -0.111098D+01
      3  -0.228738D+01 -0.884508D+00  0.387410D+01  0.452517D+01 -0.536747D+00
               151           152           153           154           155 
      1   0.105215D+01 -0.318421D+01  0.639651D+00 -0.203632D+01  0.140681D+01
      2   0.781603D+00 -0.177312D+01  0.605875D+00 -0.204135D+01 -0.590011D+00
      3  -0.129273D+01 -0.124564D+01  0.350720D+00  0.516445D+01 -0.715019D+00
               156           157           158           159           160 
      1  -0.354851D+01 -0.326067D+00 -0.105058D+00 -0.377314D+01 -0.185564D+01
      2   0.179966D+01 -0.149606D+01 -0.335442D+00  0.133854D+01 -0.218475D+01
      3   0.275815D+01  0.293390D+01  0.621392D+00  0.496777D+00  0.381447D+01
               161           162           163           164           165 
      1   0.484681D+00 -0.401461D+01 -0.410012D+01  0.159854D+01 -0.577755D+01
      2   0.992031D+00  0.214486D+01 -0.533724D+01 -0.887472D+00  0.462411D+00
      3  -0.770105D+00  0.138226D+01  0.108070D+02 -0.499068D+00  0.619798D+01
               166           167           168           169           170 
      1   0.783743D-01 -0.262537D+00 -0.141791D+01 -0.414097D+01  0.597731D-01
      2  -0.492448D+00 -0.101588D+01 -0.492251D-01 -0.363609D+01 -0.141905D+00
      3   0.145167D+01  0.164343D+01  0.727677D+00  0.658536D+01  0.324435D+00
               171           172           173           174           175 
      1  -0.506814D+01  0.125294D+01  0.198916D+01 -0.123248D+01  0.182841D+01
      2  -0.549232D-02 -0.525993D+00 -0.159547D+01  0.117818D+01 -0.712645D+00
      3   0.457391D+01  0.859944D+00  0.626594D+00 -0.135087D-01  0.378497D+01
               176           177           178           179           180 
      1   0.108562D+02 -0.954095D+01 -0.839189D+00 -0.821815D+01  0.110850D+02
      2  -0.267196D+01  0.211823D+01 -0.366639D+00  0.247097D+01 -0.331280D+01
      3  -0.203281D+01  0.772050D+00 -0.262858D+01  0.150764D+01 -0.111610D+01
               181           182           183           184           185 
      1  -0.253683D+01 -0.169144D+01  0.397298D+01  0.275933D+00  0.449015D+00
      2   0.712989D+01 -0.272485D+01 -0.257889D+01 -0.212917D+01  0.206835D+01
      3  -0.972777D+01  0.301986D+01  0.539834D+01  0.431642D+01 -0.313487D+01
               186           187           188           189           190 
      1  -0.293753D+01  0.172020D+01 -0.143133D+00 -0.398613D+01 -0.100740D+01
      2   0.141386D+01 -0.523771D+01  0.235305D+01  0.282915D+01 -0.205966D+01
      3  -0.239800D+01  0.602442D+01 -0.217324D+01 -0.418537D+01 -0.222602D+01
               191           192           193           194           195 
      1  -0.566138D+00  0.614971D+00 -0.453154D-02 -0.218214D+01  0.122806D+01
      2  -0.276370D+00  0.359284D+01  0.630968D+00 -0.423979D+01  0.650137D+01
      3  -0.176826D+01  0.138680D+01 -0.500933D-01 -0.438112D+01  0.463237D+01
               196           197           198           199           200 
      1   0.709633D+00  0.447318D+01 -0.359248D+01  0.339735D+00 -0.477968D+00
      2   0.647760D+00  0.572431D+01 -0.153608D+02  0.287709D+00  0.307503D+00
      3   0.646713D+00  0.663606D+01 -0.605733D+01  0.258260D+01 -0.337698D+01
               201           202           203           204           205 
      1   0.454847D+00 -0.694012D-01  0.145309D+01 -0.345924D+01  0.277334D+00
      2   0.167745D+01  0.563952D+00 -0.318050D+01 -0.433755D+01  0.687128D+00
      3  -0.694691D+00 -0.186951D+01  0.198496D+02  0.305158D+01 -0.793581D+00
               206           207           208           209           210 
      1   0.780967D+00 -0.624908D+00  0.174055D+01  0.844238D+00  0.880884D+00
      2  -0.167840D+01 -0.203737D+01  0.776424D+01  0.129080D+01  0.836048D+01
      3   0.322611D+01  0.156667D+01 -0.648012D+01 -0.588136D+01 -0.249067D+01
               211           212           213           214           215 
      1   0.619048D+00  0.682345D+00 -0.300060D+00  0.188838D+01  0.166505D+01
      2   0.194551D+01  0.971780D+00  0.352476D+01  0.523092D+01  0.180293D+01
      3  -0.341609D+01 -0.194311D+01 -0.118438D+01 -0.373705D+01 -0.380496D+01
               216           217           218           219           220 
      1   0.826847D+00  0.422440D+01 -0.367492D+01 -0.237894D+01 -0.159950D+01
      2   0.751601D+01  0.148989D+02 -0.693207D+00 -0.472557D+01 -0.628568D+00
      3  -0.319312D+01  0.799279D+01 -0.177380D+01 -0.323367D+01  0.612547D+00
               221           222           223           224           225 
      1   0.179373D-01 -0.760253D-01 -0.195739D+01  0.193357D+01  0.279722D+01
      2   0.198289D+01 -0.509931D+00 -0.741075D+01 -0.533576D+00  0.438935D+01
      3   0.112433D+01 -0.749345D+00 -0.328844D+01  0.145378D+00  0.219737D+01
               226           227           228           229           230 
      1   0.469626D+01  0.409608D+01  0.508290D+01  0.261472D+01  0.176916D+01
      2  -0.498504D+01 -0.864042D+00 -0.414097D+00 -0.214464D+01 -0.798773D+00
      3  -0.388721D+01 -0.323204D+01 -0.364311D+01 -0.125209D+01 -0.145065D+01
               231           232           233           234           235 
      1   0.262803D+01  0.407375D+01  0.415696D+01  0.776905D+01 -0.138536D+01
      2   0.661230D+00 -0.565359D+01  0.108231D-01  0.918767D-01 -0.156049D+00
      3  -0.155312D+01 -0.358782D+01 -0.190130D+01 -0.403749D+01  0.960381D-01
               236           237           238           239           240 
      1   0.275914D+01  0.102816D+01  0.296657D+01 -0.174627D+02 -0.378778D+01
      2   0.162592D+01  0.594230D+00  0.305912D+01 -0.190478D+01 -0.169771D+01
      3  -0.951118D+00 -0.261242D+00  0.349399D+01  0.662440D+01 -0.709178D+00
               241           242           243 
      1   0.528011D+00 -0.155042D+01 -0.231573D+01
      2  -0.528243D+00 -0.602589D+00 -0.951155D+00
      3   0.189093D+00  0.996475D+00  0.287263D+00
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.823325D+01  0.332030D+01  0.125751D+02  0.451096D+01  0.684122D+01
      2  -0.128628D+01 -0.257406D+01 -0.832885D+01 -0.391741D+01 -0.123340D+01
      3   0.951954D+01 -0.746245D+00 -0.424626D+01 -0.593556D+00 -0.560782D+01
      4  -0.904802D-01  0.408204D+01 -0.439681D+01  0.549250D+01 -0.110975D+02
      5   0.114899D+02 -0.878691D+00  0.762365D+01  0.850820D+00  0.446610D+00
      6  -0.670137D+01  0.220054D+01 -0.128153D+01  0.266324D+01 -0.456741D+01
                 6             7             8             9            10 
      1  -0.367071D+01  0.158433D+02 -0.237177D+01  0.877512D+01  0.108638D+01
      2  -0.336395D+01 -0.892783D+01 -0.156342D+01 -0.457752D+01 -0.835596D+00
      3   0.703466D+01 -0.691552D+01  0.393519D+01 -0.419760D+01 -0.250784D+00
      4  -0.371282D+00 -0.371514D+01  0.141671D+00  0.168256D+01  0.516172D+01
      5   0.532705D+01  0.883742D+01  0.456022D+01 -0.103929D+01 -0.143261D+01
      6  -0.309994D+01 -0.136438D+01 -0.364455D+01  0.269176D+01  0.646398D+01
                11            12            13            14            15 
      1   0.462662D+01  0.140197D+01  0.673594D+01 -0.112178D+01 -0.115814D+02
      2  -0.181666D+01  0.344579D+01  0.129582D+00  0.712018D+01 -0.285266D+01
      3  -0.280996D+01 -0.484776D+01 -0.686553D+01 -0.599840D+01  0.144341D+02
      4   0.325784D+01  0.312434D+01  0.383692D+00  0.157150D+01 -0.116013D+01
      5  -0.151813D+01  0.421601D+01 -0.171313D+01 -0.165995D+01 -0.379882D+01
      6  -0.153019D+01  0.656524D+00 -0.543356D+00  0.346460D+01 -0.324088D+01
                16            17            18            19            20 
      1  -0.128475D+02 -0.642829D+01 -0.201331D+01  0.629501D+01 -0.260258D+01
      2   0.477674D+01 -0.275192D+01  0.254625D+00  0.111108D+02 -0.994126D+01
      3   0.807080D+01  0.918021D+01  0.175868D+01 -0.174058D+02  0.125438D+02
      4   0.586892D+01 -0.399880D+01  0.208905D+01  0.397898D+01 -0.231199D+01
      5   0.234397D+01 -0.229171D+00  0.441828D+00 -0.914545D+01  0.280090D+01
      6  -0.252938D-02  0.753812D+00  0.992657D+01  0.398999D+01 -0.852318D+00
                21            22            23            24            25 
      1  -0.800881D+01 -0.982929D+01 -0.574354D+01  0.123129D+02 -0.162034D+01
      2  -0.383080D+01 -0.645343D+01 -0.481410D+01  0.125623D+01 -0.518672D+01
      3   0.118396D+02  0.162827D+02  0.105576D+02 -0.135691D+02  0.680706D+01
      4   0.305809D+01 -0.216351D+01 -0.261599D+01 -0.160197D+01  0.138643D+01
      5  -0.193523D+02  0.479288D+01  0.226229D+01  0.106181D+02 -0.129256D+02
      6   0.939612D+01 -0.245127D+01 -0.437846D+01  0.606467D+01  0.686011D+01
                26            27            28            29            30 
      1   0.629019D+01  0.291390D+01 -0.458425D+01 -0.147969D+02  0.558445D+01
      2   0.725875D+00  0.110115D+02 -0.589549D+01  0.233213D+02  0.475594D+00
      3  -0.701607D+01 -0.139254D+02  0.104797D+02 -0.852436D+01 -0.606005D+01
      4  -0.166897D+01  0.344449D+01 -0.167976D+02 -0.113172D+02  0.112936D+02
      5   0.709225D+01  0.282318D+01  0.110162D+02  0.746519D+01 -0.296621D+01
      6   0.425645D+01 -0.458000D+01  0.138691D+02 -0.106495D+01 -0.453539D+01
                31            32            33            34            35 
      1  -0.923507D+01  0.146933D+02 -0.182626D+00  0.458676D+01  0.124401D+01
      2   0.156914D+02 -0.218965D+02  0.808551D+01  0.547468D+00  0.685334D+01
      3  -0.645630D+01  0.720319D+01 -0.790288D+01 -0.513422D+01 -0.809734D+01
      4  -0.341410D+01  0.113464D+02  0.146566D+01  0.934394D+01  0.323808D+01
      5   0.278442D+01 -0.316961D+01  0.198594D+00 -0.381376D+01  0.540110D+00
      6  -0.150196D+01  0.860816D+01  0.131740D+01 -0.280270D+01  0.293866D+01
                36            37            38            39            40 
      1  -0.742861D+01  0.472011D+00  0.374646D+01 -0.336034D+00  0.244509D+01
      2   0.529610D+01  0.167169D+01 -0.840046D+01 -0.277920D+01 -0.518595D+01
      3   0.213251D+01 -0.214370D+01  0.465400D+01  0.311524D+01  0.274086D+01
      4   0.242393D+01  0.393827D+00 -0.672269D+01 -0.105402D+02 -0.586251D+01
      5  -0.122778D+01 -0.518210D+01 -0.798055D+01 -0.879718D+01 -0.431380D+01
      6  -0.887748D+01 -0.116236D+02 -0.101662D+02 -0.366690D+01 -0.753103D+01
                41            42            43            44            45 
      1  -0.787655D+01 -0.723227D-01 -0.282937D+01 -0.874085D+00  0.229095D+01
      2   0.113148D+02 -0.780106D+00  0.421508D+00 -0.916862D+00 -0.723171D+01
      3  -0.343829D+01  0.852428D+00  0.240787D+01  0.179095D+01  0.494075D+01
      4  -0.321554D+01 -0.492256D+01 -0.837676D+01 -0.488870D+01 -0.105870D+02
      5  -0.503165D+01 -0.671198D+01 -0.731921D+01 -0.855385D+01 -0.535645D+01
      6   0.318702D+00 -0.749641D+01 -0.603767D+01 -0.106400D+02  0.173023D+01
                46            47            48            49            50 
      1  -0.513974D+02 -0.615701D+01  0.345216D+01 -0.182507D+02  0.131995D+01
      2   0.243133D+02 -0.206920D+01 -0.359091D+01  0.876467D+01 -0.361689D+01
      3   0.270841D+02  0.822621D+01  0.138756D+00  0.948599D+01  0.229694D+01
      4  -0.129556D+02 -0.850613D+01  0.151378D+01  0.724123D+00 -0.427648D+01
      5   0.549835D+01  0.356296D+01 -0.799127D+01  0.279765D+01  0.168987D+00
      6   0.639789D+00  0.667410D+00 -0.566613D+01  0.319876D+01 -0.493356D+01
                51            52            53            54            55 
      1   0.115421D+02  0.107504D+01  0.949927D+01 -0.654530D+00  0.216106D+01
      2  -0.699245D+00  0.175929D+01 -0.555698D+01 -0.191907D+01 -0.637930D+01
      3  -0.108429D+02 -0.283433D+01 -0.394229D+01  0.257360D+01  0.421824D+01
      4   0.154198D+01 -0.977868D+00  0.341490D+01 -0.267880D+01  0.249651D+01
      5  -0.487025D+01  0.452611D+01 -0.926263D+00 -0.654718D+00 -0.165399D+01
      6  -0.281821D+01 -0.283412D+00  0.569843D+00 -0.609485D+01  0.353895D+01
                56            57            58            59            60 
      1  -0.736102D+01 -0.675715D+01  0.167572D+01 -0.199511D+01 -0.826923D+01
      2   0.162311D+02  0.183914D+01  0.869198D+01 -0.112424D+02 -0.266311D+00
      3  -0.887008D+01  0.491801D+01 -0.103677D+02  0.132375D+02  0.853554D+01
      4  -0.124648D+02  0.156600D+00 -0.800893D+01  0.173054D+02 -0.106353D+01
      5  -0.153876D+01 -0.512621D-01 -0.126886D+00  0.317600D+01  0.818651D-01
      6   0.942751D+01  0.346191D+01  0.354202D+01  0.120274D+01  0.870708D+01
                61            62            63            64            65 
      1   0.236527D+01 -0.282420D+01  0.977200D+01  0.561502D+01 -0.535263D+01
      2  -0.538263D+01  0.805313D+01  0.148520D+02  0.394593D+01  0.233347D+01
      3   0.301736D+01 -0.522892D+01 -0.246240D+02 -0.956095D+01  0.301916D+01
      4   0.328832D+01 -0.315903D+01  0.594366D+01 -0.530250D+01 -0.881765D+01
      5   0.603764D+00  0.927346D+00  0.130011D+02 -0.872571D+01 -0.789208D+01
      6   0.123061D+01  0.543130D+01 -0.828492D+01 -0.200070D+02  0.746173D+01
                66            67            68            69            70 
      1  -0.932925D+01 -0.487855D+01 -0.147289D+01 -0.207549D+01 -0.752890D+01
      2   0.110491D+02  0.125605D+01 -0.421886D+01  0.167354D+02  0.100953D+02
      3  -0.171986D+01  0.362249D+01  0.569175D+01 -0.146599D+02 -0.256639D+01
      4  -0.181689D+02 -0.609611D+01  0.161916D+01  0.833002D+01 -0.157817D+02
      5  -0.170973D+02 -0.396718D+01  0.672514D+01  0.346830D+00 -0.141671D+02
      6  -0.465793D+00  0.696960D+01  0.131963D+02 -0.621418D+01 -0.381795D+00
                71            72            73            74            75 
      1  -0.535234D+01  0.317480D+01  0.104015D+03  0.130717D+02 -0.412348D+01
      2   0.198709D+02 -0.736643D+01 -0.504869D+02 -0.326564D+01  0.311646D+01
      3  -0.145185D+02  0.419163D+01 -0.535280D+02 -0.980602D+01  0.100702D+01
      4   0.933759D+01 -0.428438D+01  0.177688D+02  0.212543D+02 -0.985390D+00
      5  -0.850416D+00 -0.134705D+01 -0.880785D+01 -0.177317D+01  0.188771D+02
      6  -0.995279D+01 -0.615187D+01 -0.487216D+01 -0.261230D+01  0.350522D+01
                76            77            78            79            80 
      1   0.160751D+02  0.131415D+02 -0.315828D+01  0.186688D+01 -0.239547D+01
      2  -0.673468D+01 -0.121916D+01  0.188907D+01  0.168609D+01  0.108755D+01
      3  -0.934042D+01 -0.119224D+02  0.126921D+01 -0.355297D+01  0.130792D+01
      4   0.243296D+02  0.127379D+02 -0.282857D+01 -0.317993D+01 -0.202349D+01
      5  -0.482608D+01 -0.344014D+01  0.526966D+01  0.210531D+02  0.462693D+01
      6  -0.368622D+01 -0.188553D+01  0.550421D+01  0.249774D+01  0.442499D+01
                81            82            83            84            85 
      1   0.105592D+02 -0.469389D+01 -0.110787D+02 -0.236403D+02 -0.160409D+02
      2  -0.997933D+01  0.465655D+01  0.808982D+01  0.124531D+02  0.139873D+02
      3  -0.579844D+00  0.373310D-01  0.298889D+01  0.111872D+02  0.205365D+01
      4   0.394366D+01 -0.100002D+02 -0.587432D+01  0.107316D+01 -0.988401D+01
      5  -0.460132D+01 -0.239428D+02 -0.100099D+01 -0.104053D+02 -0.402680D+01
      6  -0.767397D+00  0.406117D+01  0.103738D+01  0.110375D+01  0.178849D+01
                86            87            88            89            90 
      1  -0.958159D+00 -0.849583D+00 -0.287541D+02 -0.748446D+00 -0.133600D+02
      2  -0.931911D+01 -0.247576D+01  0.146843D+02 -0.268958D+01  0.106199D+02
      3   0.102773D+02  0.332534D+01  0.140698D+02  0.343803D+01  0.274007D+01
      4   0.260378D+02  0.693000D+01 -0.113169D+01  0.661927D+01 -0.964582D+01
      5   0.703271D+01 -0.121301D+02 -0.149616D+02 -0.112430D+02  0.886866D+01
      6  -0.555000D+01  0.134826D+01  0.684836D+00  0.161822D+01 -0.837667D+00
                91            92            93            94            95 
      1   0.105235D+02 -0.246416D+01 -0.785908D+01 -0.363476D+01  0.354530D+01
      2   0.107819D+02  0.835270D+01  0.130427D+02  0.109260D+02 -0.231731D+02
      3  -0.213055D+02 -0.588854D+01 -0.518365D+01 -0.729128D+01  0.196278D+02
      4  -0.549140D+01 -0.173441D+01  0.641527D+01 -0.228913D+01  0.140709D+02
      5  -0.343816D+01 -0.221653D+01 -0.221159D+02 -0.498405D+01 -0.307079D+01
      6   0.472007D+01 -0.265572D+01 -0.307696D+01 -0.411023D+01  0.116752D+02
                96            97            98            99           100 
      1   0.492021D+01 -0.788803D+01  0.645502D+01 -0.931863D+01 -0.117525D+01
      2   0.738031D+01  0.132172D+02  0.605398D+00  0.137359D+02 -0.901702D+01
      3  -0.123005D+02 -0.532918D+01 -0.706042D+01 -0.441723D+01  0.101923D+02
      4   0.159670D+01  0.572707D+01  0.385927D+01 -0.229156D+01 -0.111163D+01
      5  -0.954607D+01 -0.203232D+02 -0.653813D+01 -0.962021D+01 -0.100083D+02
      6   0.801674D+01 -0.125457D+01  0.917815D+01 -0.952211D+01 -0.146903D+00
               101           102           103           104           105 
      1  -0.336523D+00  0.724545D+01  0.237792D+01 -0.292215D+01 -0.766979D+01
      2   0.382192D+01  0.113880D+02  0.327984D+01 -0.144878D+01 -0.652648D+01
      3  -0.348540D+01 -0.186335D+02 -0.565776D+01  0.437092D+01  0.141963D+02
      4   0.221215D+01 -0.273916D+00  0.177225D+01 -0.103841D+01 -0.123991D+01
      5   0.196747D+01  0.145538D+02  0.278132D+01 -0.360357D+01 -0.445729D+01
      6  -0.460789D+01 -0.789626D+00 -0.244823D+01  0.513287D+01  0.612335D+01
               106           107           108           109           110 
      1   0.383954D+01 -0.232813D+01 -0.169547D+02  0.362114D+01  0.198949D+01
      2   0.746209D+01 -0.337001D+01 -0.216355D+02 -0.118998D+02  0.900298D+00
      3  -0.113016D+02  0.569814D+01  0.385902D+02  0.827862D+01 -0.288979D+01
      4  -0.255428D+00 -0.138149D+01 -0.106964D+01 -0.887604D+01  0.559847D+01
      5   0.114811D+02 -0.310194D+01 -0.136842D+02  0.218326D+02 -0.484583D+01
      6  -0.984871D+00  0.577145D+01  0.123482D+01 -0.712069D+01  0.751303D+01
               111           112           113           114           115 
      1  -0.306078D+01  0.131112D+01 -0.172387D+01  0.229144D+01 -0.174070D+01
      2  -0.104946D+02  0.103301D+01  0.146970D+01  0.175239D+00 -0.612066D+01
      3   0.135554D+02 -0.234413D+01  0.254168D+00 -0.246668D+01  0.786136D+01
      4  -0.668593D+01  0.573266D+01 -0.268775D+01  0.348969D+01 -0.399125D+01
      5   0.200498D+02 -0.424849D+01  0.409899D+01 -0.455252D+01  0.130256D+02
      6  -0.902968D+01  0.527351D+01 -0.554260D+01  0.736788D+01 -0.566867D+01
               116           117           118           119           120 
      1   0.167485D+01 -0.704554D+01 -0.257635D+01  0.118135D+02 -0.378573D+01
      2   0.167551D+00 -0.117126D+02  0.825579D+01 -0.212400D+02  0.259474D+01
      3  -0.184240D+01  0.187581D+02 -0.567944D+01  0.942653D+01  0.119099D+01
      4   0.208528D+01 -0.484656D+01 -0.556088D+01  0.112497D+02 -0.297975D+01
      5  -0.391981D+01  0.132202D+02  0.124957D+01 -0.368102D+01  0.231618D+01
      6   0.522780D+01 -0.769611D+01 -0.511768D+01  0.851987D+01 -0.527648D+01
               121           122           123           124           125 
      1   0.654883D+01 -0.301979D+02  0.618041D+01 -0.133045D+01  0.361909D+01
      2  -0.107257D+02  0.546530D+02 -0.785427D+01  0.182520D+00 -0.307210D+01
      3   0.417688D+01 -0.244551D+02  0.167386D+01  0.114793D+01 -0.546991D+00
      4   0.909452D+01 -0.723415D+01  0.588834D+00 -0.154748D+01  0.398894D+00
      5  -0.298547D+01  0.232625D+01 -0.601209D+00  0.210612D+01 -0.614471D+00
      6   0.336734D+01 -0.200247D+02  0.110643D+02 -0.241064D+01  0.100415D+02
               126           127           128           129           130 
      1  -0.484697D+01  0.173907D+02  0.240435D+01 -0.147085D+01  0.150878D+01
      2   0.463661D+01 -0.267366D+01  0.553747D+01  0.731277D+00  0.292029D+01
      3   0.210356D+00 -0.147170D+02 -0.794182D+01  0.739571D+00 -0.442907D+01
      4  -0.214887D+01  0.294081D+02  0.193369D+02 -0.106606D+02  0.117290D+02
      5   0.932958D+00 -0.177728D+02 -0.861475D+01  0.103740D+02 -0.405804D+01
      6  -0.337937D+01 -0.131682D+02 -0.966677D+01  0.106427D+02 -0.517190D+01
               131           132           133           134           135 
      1  -0.144313D+01  0.768631D+00 -0.208660D+01  0.108218D+01  0.614370D+00
      2   0.848463D+01 -0.299920D+01  0.184464D+01 -0.261724D+01 -0.301841D+01
      3  -0.704149D+01  0.223057D+01  0.241965D+00  0.153506D+01  0.240404D+01
      4   0.891991D+01 -0.431197D+01 -0.835418D+01 -0.554542D+01  0.681482D+01
      5  -0.408351D+01  0.273687D+01  0.100733D+02  0.452963D+01 -0.696044D+01
      6  -0.722226D+01  0.447942D+01  0.795965D+01  0.678118D+01 -0.696775D+01
               136           137           138           139           140 
      1  -0.771453D+00  0.112399D+01 -0.530527D-01  0.206240D+01 -0.307782D+01
      2  -0.389516D+01 -0.116227D+01  0.430772D+01 -0.284165D+01  0.109144D+01
      3   0.466661D+01  0.382831D-01 -0.425467D+01  0.779246D+00  0.198638D+01
      4  -0.130233D+01  0.421028D+01  0.364706D+01  0.119937D+01 -0.228133D+01
      5  -0.497978D+01  0.155885D+01  0.103029D+02 -0.212250D+01 -0.191375D+01
      6   0.211682D+01 -0.233141D+01 -0.262724D+01 -0.105362D+01  0.175484D+01
               141           142           143           144           145 
      1   0.723730D-01 -0.108611D+01 -0.524778D+01 -0.230322D+02  0.597368D+01
      2   0.564903D+01  0.523127D+01  0.910300D+00 -0.216206D+02  0.511701D+01
      3  -0.572141D+01 -0.414516D+01  0.433748D+01  0.446527D+02 -0.110907D+02
      4  -0.114509D+01  0.388301D+01 -0.303621D+01 -0.670672D+01 -0.164140D+02
      5   0.326880D+01  0.957927D+01 -0.318748D+01 -0.203769D+02 -0.414123D+01
      6   0.441120D+01 -0.402079D+01  0.901065D+01  0.204924D+02  0.378621D+01
               146           147           148           149           150 
      1   0.301295D+00  0.154221D+01 -0.163923D+00 -0.126033D+02 -0.192037D+01
      2  -0.111151D+02 -0.132021D+01 -0.102318D+02  0.339876D+02  0.147036D+01
      3   0.108138D+02 -0.222006D+00  0.103957D+02 -0.213843D+02  0.450013D+00
      4   0.209675D+02  0.336696D+01  0.174436D+02 -0.277890D+02 -0.283713D+01
      5   0.567373D+01  0.414584D+01  0.432320D+01 -0.430498D+01 -0.327461D+01
      6  -0.686357D+01 -0.417426D+01 -0.570610D+01  0.119669D+02  0.685896D+01
               151           152           153           154           155 
      1   0.242373D+01 -0.253054D+00 -0.357169D+01  0.598323D+01 -0.625338D+00
      2   0.785678D+00 -0.555410D+01  0.148372D+01 -0.852626D+00  0.548978D+01
      3  -0.320941D+01  0.580716D+01  0.208797D+01 -0.513060D+01 -0.486444D+01
      4  -0.367946D+01  0.436341D+01 -0.386883D+01  0.156959D+02  0.148318D+02
      5   0.128282D+01 -0.251342D+01 -0.124626D+01  0.135318D+02  0.825197D+01
      6  -0.208403D+01  0.449691D+01  0.196218D+01  0.105651D+02  0.936904D+01
               156           157           158           159           160 
      1   0.952537D+00 -0.139988D+01 -0.538784D+01 -0.366471D+01  0.730338D+00
      2  -0.130405D+01  0.524404D+01  0.111734D+02  0.437191D+01 -0.159879D+01
      3   0.351510D+00 -0.384415D+01 -0.578556D+01 -0.707200D+00  0.868454D+00
      4   0.103757D+02  0.116987D+02  0.123868D+02  0.741244D+01  0.943083D+01
      5   0.119464D+02  0.556671D+01  0.718681D+01  0.550805D+01  0.115749D+02
      6   0.956994D+01  0.740506D+01  0.114901D+02  0.118836D+02  0.910354D+01
               161           162           163           164           165 
      1  -0.437005D+01 -0.554172D+01  0.897320D+01 -0.212447D+01  0.108320D+01
      2   0.366194D+01 -0.480661D+00 -0.899997D+01  0.531100D+01 -0.773399D+01
      3   0.708103D+00  0.602238D+01  0.267700D-01 -0.318653D+01  0.665079D+01
      4   0.865668D+01  0.101239D+02  0.201212D+02  0.124680D+02  0.137941D+02
      5   0.766968D+01  0.128858D+02  0.206342D+02  0.759676D+01  0.179204D+02
      6   0.140654D+02  0.157839D+02  0.138079D+02  0.911553D+01  0.132357D+02
               166           167           168           169           170 
      1  -0.844719D+00 -0.670422D+00 -0.106427D+01  0.206407D+01 -0.250960D+01
      2   0.320823D+01  0.249414D+01  0.143744D+01 -0.716396D+01  0.538752D+00
      3  -0.236351D+01 -0.182372D+01 -0.373167D+00  0.509990D+01  0.197085D+01
      4   0.637152D+01  0.463695D+01  0.288901D+01  0.120847D+02  0.513821D+01
      5   0.187155D+01  0.326162D+01  0.102209D+01  0.153394D+02  0.476795D+01
      6   0.374397D+01  0.269713D+01  0.523655D+01  0.958248D+01  0.102285D+02
               171           172           173           174           175 
      1  -0.405845D+01 -0.509533D+00  0.139638D-01  0.481955D+00 -0.320147D+00
      2  -0.631607D+01  0.303020D+01  0.441467D+01 -0.271890D+01  0.447526D+01
      3   0.103745D+02 -0.252066D+01 -0.442863D+01  0.223694D+01 -0.415512D+01
      4   0.961218D+01  0.444901D+01  0.842045D+01 -0.118783D+01  0.799242D+01
      5   0.146228D+02  0.493023D+00  0.378968D+00  0.369001D+01  0.433110D+00
      6   0.140669D+02  0.415958D+00 -0.148828D+01  0.171754D+01 -0.132416D+01
               176           177           178           179           180 
      1  -0.139861D+02  0.379739D+01  0.267333D+00  0.918642D+01 -0.358643D+01
      2   0.349005D+02 -0.128668D+02 -0.376728D+01 -0.231893D+02  0.931269D+01
      3  -0.209144D+02  0.906942D+01  0.349994D+01  0.140029D+02 -0.572626D+01
      4   0.935748D+01 -0.377605D+01 -0.464015D+01 -0.775209D+01  0.342457D+01
      5  -0.221133D+01  0.178996D+01  0.229660D+01  0.224216D+01 -0.270376D+01
      6  -0.585650D+01  0.961125D+01  0.113314D+01  0.818853D+01 -0.120052D+02
               181           182           183           184           185 
      1  -0.268423D+01  0.957982D+01  0.911751D+01  0.442440D+01 -0.839820D+01
      2   0.242381D+00 -0.105143D+02 -0.197263D+01 -0.495098D+01  0.105724D+02
      3   0.244185D+01  0.934494D+00 -0.714488D+01  0.526579D+00 -0.217421D+01
      4  -0.134588D+02  0.864807D+01  0.953002D+01  0.646781D+01 -0.644659D+01
      5  -0.931080D+01  0.541927D+01  0.863140D+01  0.290632D+01 -0.434780D+01
      6   0.109054D+02 -0.131977D+02 -0.136059D+02 -0.659028D+01  0.939571D+01
               186           187           188           189           190 
      1  -0.596000D+01  0.550360D+01 -0.858350D+01 -0.117597D+02  0.667955D+01
      2   0.347864D+01 -0.135318D+01  0.462644D+01  0.758132D+00 -0.547714D+01
      3   0.248137D+01 -0.415042D+01  0.395706D+01  0.110016D+02 -0.120241D+01
      4  -0.488635D+01  0.904574D+01 -0.538807D+01 -0.584255D+01  0.321017D+01
      5  -0.245436D+01  0.816281D+01 -0.294156D+01 -0.561726D+01 -0.538063D+01
      6   0.104509D+02 -0.765566D+01  0.144995D+02  0.170783D+02 -0.940874D+00
               191           192           193           194           195 
      1   0.389009D+01 -0.366865D+01  0.928112D+01 -0.190265D+00 -0.112126D+01
      2  -0.258232D+01  0.437635D+01 -0.602526D+01  0.933578D+00  0.281889D+01
      3  -0.130778D+01 -0.707696D+00 -0.325586D+01 -0.743313D+00 -0.169763D+01
      4   0.306920D+01 -0.205101D+01  0.349773D+01  0.340478D+01 -0.568350D+01
      5  -0.290292D+01  0.105095D+02 -0.400869D+01 -0.555641D+01  0.921050D+01
      6  -0.611131D+00 -0.193115D+00 -0.355535D+00 -0.167323D+01  0.208685D+01
               196           197           198           199           200 
      1  -0.105448D+02  0.735254D-01  0.438941D+01  0.664968D+01 -0.478423D+01
      2   0.805825D+01  0.231260D+01 -0.121436D+02 -0.584375D+00  0.550206D-01
      3   0.248650D+01 -0.238612D+01  0.775418D+01 -0.606531D+01  0.472921D+01
      4  -0.678435D+00 -0.797923D+01  0.624121D+01 -0.738958D+01  0.112634D+02
      5   0.149130D+02  0.717532D+01 -0.248785D+02  0.303272D+00  0.247518D+01
      6  -0.992012D+00  0.324202D+01  0.834954D+00  0.124255D+01 -0.126018D+01
               201           202           203           204           205 
      1   0.965195D+00 -0.108389D+02 -0.255656D+01  0.452298D+00  0.116676D+01
      2  -0.721558D+00 -0.110983D+01  0.200230D+02  0.158238D+01 -0.890096D+00
      3  -0.243637D+00  0.119487D+02 -0.174664D+02 -0.203468D+01 -0.276664D+00
      4   0.214528D+01  0.206651D+02 -0.371447D+02 -0.568979D+01  0.294985D+01
      5   0.338093D+01  0.403472D+01 -0.514523D+01 -0.612390D+01  0.549585D+01
      6  -0.101856D+01 -0.243336D+01  0.700186D+01  0.659555D+01 -0.214982D+01
               206           207           208           209           210 
      1  -0.417617D-01  0.725705D+00  0.498035D+02  0.589415D+01  0.155296D+02
      2   0.157276D+01  0.247622D+00 -0.269197D+02 -0.357787D+01 -0.924556D+01
      3  -0.153100D+01 -0.973326D+00 -0.228838D+02 -0.231628D+01 -0.628406D+01
      4  -0.507972D+01 -0.370317D+01  0.252043D+01  0.826741D+01  0.953414D+00
      5  -0.390665D+01 -0.352820D+01  0.183359D+02  0.203264D+01  0.140526D+02
      6   0.574389D+01  0.223611D+01 -0.178723D+01  0.603498D+00 -0.144167D+01
               211           212           213           214           215 
      1   0.143523D+02  0.544574D+01  0.346508D+01  0.288413D+02  0.227403D+01
      2  -0.825514D+01 -0.123540D+01 -0.193726D+01 -0.167322D+02 -0.139119D+01
      3  -0.609715D+01 -0.421033D+01 -0.152781D+01 -0.121092D+02 -0.882841D+00
      4   0.969232D+01  0.217245D+01  0.292660D+01  0.774548D+00  0.566786D+01
      5   0.527155D+01  0.285362D+01  0.581362D+01  0.192937D+02  0.323093D+01
      6   0.102527D+01  0.145145D+01  0.161296D+01 -0.116100D+01  0.181771D+01
               216           217           218           219           220 
      1   0.116327D+02 -0.489936D+01 -0.407273D+01  0.110511D+02 -0.964683D+00
      2  -0.102551D+02 -0.427793D+01  0.133920D+01  0.398376D+01 -0.501982D+00
      3  -0.137752D+01  0.917729D+01  0.273352D+01 -0.150349D+02  0.146666D+01
      4   0.241443D+01  0.917305D+01  0.228258D+01 -0.491859D+01  0.234836D+01
      5   0.150576D+02 -0.155622D+02 -0.285137D+00  0.986659D+01  0.333339D+00
      6  -0.114146D+01 -0.342247D+01 -0.704444D+01  0.867774D+01 -0.315748D+01
               221           222           223           224           225 
      1  -0.231752D+01  0.639307D+00  0.664924D+01  0.138358D+01 -0.868976D+01
      2   0.327829D+01 -0.211799D+01  0.201281D+01 -0.743465D+00 -0.750475D+01
      3  -0.960774D+00  0.147868D+01 -0.866205D+01 -0.640111D+00  0.161945D+02
      4  -0.720010D-01 -0.983632D+00 -0.450397D+01 -0.138782D+01  0.351994D+01
      5  -0.207597D+01  0.236598D+01  0.103889D+02  0.136404D+01 -0.569768D+01
      6  -0.225953D+01  0.254402D+01  0.381760D+01  0.364114D+01 -0.542218D+01
               226           227           228           229           230 
      1   0.821354D+01  0.183571D+01  0.942711D+00  0.298768D+01 -0.470844D+00
      2  -0.163505D+02 -0.323989D+01 -0.171097D+02 -0.627609D+01 -0.252335D+00
      3   0.813691D+01  0.140418D+01  0.161670D+02  0.328841D+01  0.723180D+00
      4  -0.390646D+01  0.422934D+01 -0.434056D+01  0.232629D+01  0.349101D+00
      5   0.223781D+02  0.701636D+00  0.245610D+02  0.718954D+01  0.446518D+01
      6  -0.208767D+01  0.566361D+01 -0.368130D+01  0.355161D+01  0.164818D+01
               231           232           233           234           235 
      1  -0.158624D+01  0.172643D+01  0.196937D+00 -0.721980D+01  0.532048D-01
      2  -0.785053D+01 -0.137622D+02 -0.238186D+01 -0.232155D+02  0.171353D+01
      3   0.943678D+01  0.120357D+02  0.218493D+01  0.304353D+02 -0.176673D+01
      4   0.198210D+01 -0.393907D+01  0.227728D+01 -0.279329D+01 -0.471813D+01
      5   0.825868D+01  0.200653D+02  0.131392D+01  0.255308D+02  0.245596D+01
      6   0.377437D+01 -0.220621D+01  0.531616D+01 -0.466604D+01 -0.312693D+01
               236           237           238           239           240 
      1  -0.519010D+00 -0.185981D+00 -0.563832D+00 -0.177258D+02  0.537915D+01
      2  -0.436669D+01 -0.147576D+01 -0.506170D+01  0.378788D+02 -0.168991D+01
      3   0.488570D+01  0.166174D+01  0.562553D+01 -0.201530D+02 -0.368925D+01
      4   0.887888D+01 -0.172039D+01  0.102450D+02 -0.190150D+02  0.308298D+01
      5  -0.321950D+01  0.474440D+01 -0.455600D+01  0.561047D+01 -0.329552D+01
      6   0.437402D+01 -0.143661D+01  0.527040D+01 -0.255736D+02  0.107957D+02
               241           242           243 
      1  -0.515791D+00  0.324415D+00 -0.108990D+01
      2  -0.170270D+01  0.378655D+01  0.144420D+01
      3   0.221849D+01 -0.411096D+01 -0.354297D+00
      4   0.969169D+00 -0.190935D+01 -0.121120D+01
      5   0.255583D+01 -0.512315D+00  0.889630D+00
      6  -0.406905D+00  0.377272D+01 -0.106228D+00
 Leave Link  716 at Fri Jul 16 22:02:58 2021, MaxMem=  5637144576 cpu:               2.5 elap:               0.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l9999.exe)
 AllDun F.D. properties on file 20721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.121488D+03  0.100203D+01 -0.265460D+00
      2   0.100203D+01  0.116779D+03  0.153747D+01
      3  -0.265460D+00  0.153747D+01  0.112986D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1   0.353882D-01 -0.440360D+01  0.230893D+01
      2   0.211408D+01 -0.464285D+01  0.212555D+02
      3   0.470251D+01 -0.171946D+02  0.524943D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1   0.259452D+02 -0.134841D+02  0.116965D+02
      2  -0.164690D+02  0.623101D+01 -0.862976D+01
      3  -0.947621D+01  0.725312D+01 -0.306671D+01
      4  -0.181576D+02  0.336086D+02 -0.178955D+02
      5   0.868593D+01 -0.180472D+02  0.434177D+02
      6  -0.109234D+02 -0.142850D+02 -0.512681D+01
 AllDun F.D. properties on file 20722 Mask=       B NFrqRd=     1 NDeriv=    81 ND12= 1 LenFil=    2919:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.180770D+01  0.138670D+01  0.527430D+01  0.887093D+00  0.242698D+01
      2   0.138670D+01  0.272765D+01  0.330987D+00  0.242698D+01 -0.551383D+01
      3   0.527430D+01  0.330987D+00  0.273494D+01  0.241642D-01 -0.137066D+01
                 6             7             8             9            10 
      1   0.241642D-01  0.628433D+01  0.543057D+00  0.200773D+01 -0.408498D+01
      2  -0.137066D+01  0.543057D+00 -0.136212D+01  0.370741D+01 -0.192719D+01
      3   0.288449D+01  0.200773D+01  0.370741D+01 -0.807982D+00 -0.397765D+01
                11            12            13            14            15 
      1  -0.192719D+01 -0.397765D+01 -0.240438D+01  0.649674D+00  0.196174D+01
      2   0.897520D+00  0.201736D+01  0.649674D+00  0.341565D+00  0.262577D+01
      3   0.201736D+01 -0.627517D+00  0.196174D+01  0.262577D+01 -0.357589D+01
                16            17            18            19            20 
      1  -0.391003D+01  0.195175D+01 -0.187998D+01  0.221608D+01 -0.331609D+00
      2   0.195175D+01  0.206046D+01 -0.262728D+01 -0.331609D+00 -0.121825D+01
      3  -0.187998D+01 -0.262728D+01 -0.174760D+01  0.404211D+01 -0.249650D+01
                21            22            23            24            25 
      1   0.404211D+01  0.559608D+00 -0.208704D+00 -0.347295D+01  0.271339D+01
      2  -0.249650D+01 -0.208704D+00  0.574004D+00 -0.214665D+01 -0.222048D+01
      3  -0.649859D+00 -0.347295D+01 -0.214665D+01  0.214333D+01 -0.208393D+00
                26            27            28            29            30 
      1  -0.222048D+01 -0.208393D+00 -0.368190D+01 -0.237563D+01  0.225023D+01
      2  -0.282560D+01  0.148324D+01 -0.237563D+01  0.364326D+01  0.873220D+00
      3   0.148324D+01  0.237826D+01  0.225023D+01  0.873220D+00 -0.264800D+00
                31            32            33            34            35 
      1  -0.946313D+00  0.287687D+01  0.887783D+00  0.184530D+01  0.937942D+00
      2   0.287687D+01 -0.342058D+01  0.179032D+01  0.937942D+00  0.145500D+01
      3   0.887783D+00  0.179032D+01  0.168262D+01 -0.764108D-01  0.143692D+01
                36            37            38            39            40 
      1  -0.764108D-01  0.735268D+00 -0.106744D+01 -0.378273D+01  0.132315D+00
      2   0.143692D+01 -0.106744D+01 -0.302486D+01 -0.146541D+01 -0.400419D+01
      3  -0.246652D+01 -0.378273D+01 -0.146541D+01 -0.166323D+01 -0.172866D+01
                41            42            43            44            45 
      1  -0.400419D+01 -0.172866D+01 -0.308769D+01 -0.150231D+01 -0.176746D+01
      2   0.450541D+01 -0.146257D+01 -0.150231D+01 -0.305673D+00 -0.328367D+01
      3  -0.146257D+01 -0.243217D+01 -0.176746D+01 -0.328367D+01  0.166639D+01
                46            47            48            49            50 
      1   0.746509D+01  0.300187D+01  0.134811D+00  0.283210D+01 -0.104708D+01
      2   0.300187D+01 -0.335833D+01 -0.279409D+01 -0.104708D+01 -0.635104D+00
      3   0.134811D+00 -0.279409D+01 -0.187634D+01 -0.173674D+01 -0.796582D+00
                51            52            53            54            55 
      1  -0.173674D+01  0.264402D+00 -0.126576D+01  0.150096D+00 -0.110759D+01
      2  -0.796582D+00 -0.126576D+01 -0.442870D+00  0.480985D+00 -0.985148D+00
      3   0.203670D+00  0.150096D+00  0.480985D+00  0.171970D+01  0.120701D+01
                56            57            58            59            60 
      1  -0.985148D+00  0.120701D+01 -0.148093D+01  0.345888D+01  0.941362D+00
      2   0.457479D+01  0.131445D+01  0.345888D+01 -0.290134D+01  0.130598D+01
      3   0.131445D+01  0.141788D+01  0.941362D+00  0.130598D+01  0.185569D+01
                61            62            63            64            65 
      1   0.258164D+00 -0.436330D+00  0.111607D+01  0.149314D+01  0.193307D+01
      2  -0.436330D+00  0.164751D+01  0.636736D+00  0.193307D+01 -0.222830D+00
      3   0.111607D+01  0.636736D+00 -0.532414D+01  0.459794D+01 -0.120324D+01
                66            67            68            69            70 
      1   0.459794D+01  0.142426D+01 -0.682511D+00 -0.123935D+01  0.387054D+01
      2  -0.120324D+01 -0.682511D+00 -0.394420D-01 -0.272653D+01 -0.138438D+01
      3   0.969352D+00 -0.123935D+01 -0.272653D+01  0.250862D+01  0.844461D+00
                71            72            73            74            75 
      1  -0.138438D+01  0.844461D+00 -0.159708D+02 -0.301136D+01  0.104505D+01
      2  -0.274136D+01  0.293496D+01 -0.301136D+01 -0.112834D+01  0.809520D+00
      3   0.293496D+01  0.770290D+00  0.104505D+01  0.809520D+00 -0.938323D+00
                76            77            78            79            80 
      1  -0.326335D+01 -0.336973D+01  0.579340D+00  0.343761D+00  0.243581D+00
      2  -0.336973D+01 -0.205211D+01  0.585965D+00  0.243581D+00  0.135559D+00
      3   0.579340D+00  0.585965D+00 -0.386101D+00 -0.297214D+01 -0.846724D+00
                81            82            83            84            85 
      1  -0.297214D+01 -0.112613D+01 -0.167412D+01 -0.410371D+01 -0.208117D+01
      2  -0.846724D+00 -0.167412D+01 -0.146357D+01 -0.286513D+00 -0.215380D+01
      3  -0.265457D-02 -0.410371D+01 -0.286513D+00 -0.192094D+01 -0.413513D+00
                86            87            88            89            90 
      1  -0.215380D+01 -0.413513D+00 -0.478796D+01 -0.425560D+00 -0.229018D+01
      2   0.529991D+01  0.169294D+01 -0.425560D+00  0.164021D+01 -0.262607D+01
      3   0.169294D+01 -0.270093D+01 -0.229018D+01 -0.262607D+01  0.225387D+01
                91            92            93            94            95 
      1   0.171258D+01 -0.549562D+00 -0.466542D+01 -0.796548D+00 -0.175982D+01
      2  -0.549562D+00 -0.156818D+01 -0.609763D+00 -0.175982D+01  0.536763D+01
      3  -0.466542D+01 -0.609763D+00 -0.187079D+01 -0.859190D+00  0.108956D+01
                96            97            98            99           100 
      1  -0.859190D+00 -0.436663D+01 -0.780950D+00 -0.177496D+01  0.220775D+01
      2   0.108956D+01 -0.780950D+00  0.178137D+01 -0.262813D+01 -0.332444D+00
      3  -0.308676D+01 -0.177496D+01 -0.262813D+01 -0.572860D+00 -0.222306D+01
               101           102           103           104           105 
      1  -0.332444D+00 -0.222306D+01 -0.948497D+00  0.633901D+00  0.121181D+01
      2   0.117034D+01  0.634474D+00  0.633901D+00 -0.110745D+01 -0.952070D+00
      3   0.634474D+00  0.326963D+01  0.121181D+01 -0.952070D+00 -0.246827D+01
               106           107           108           109           110 
      1  -0.178755D+01  0.445751D+00  0.200426D+01 -0.440109D+01  0.975553D+00
      2   0.445751D+00 -0.903728D+00 -0.969970D+00  0.975553D+00 -0.143620D+01
      3   0.200426D+01 -0.969970D+00 -0.632875D+01 -0.338005D+01  0.125391D+01
               111           112           113           114           115 
      1  -0.338005D+01  0.836029D+00 -0.908925D+00  0.826446D+00 -0.201278D+01
      2   0.125391D+01 -0.908925D+00  0.987919D+00 -0.899719D+00  0.728537D+00
      3  -0.376260D+01  0.826446D+00 -0.899719D+00  0.844685D+00 -0.200494D+01
               116           117           118           119           120 
      1   0.728537D+00 -0.200494D+01 -0.957226D+00  0.197268D+01 -0.611073D+00
      2  -0.643023D+00  0.685759D+00  0.197268D+01 -0.379278D+01  0.709852D+00
      3   0.685759D+00 -0.378795D+01 -0.611073D+00  0.709852D+00 -0.896555D+00
               121           122           123           124           125 
      1   0.149992D+01 -0.180356D+01  0.238157D+00 -0.324920D+00  0.416312D-01
      2  -0.180356D+01  0.880849D+01 -0.169080D+01  0.416312D-01 -0.807716D+00
      3   0.238157D+00 -0.169080D+01  0.132043D+01 -0.399598D+00  0.104652D+01
               126           127           128           129           130 
      1  -0.399598D+00  0.636885D+01  0.273227D+01 -0.210907D+01  0.146152D+01
      2   0.104652D+01  0.273227D+01  0.250861D+01 -0.122039D+01  0.136065D+01
      3  -0.388119D+00 -0.210907D+01 -0.122039D+01  0.199838D+01 -0.652494D+00
               131           132           133           134           135 
      1   0.136065D+01 -0.652494D+00 -0.181131D+01 -0.867857D+00  0.147060D+01
      2   0.196394D+01 -0.831224D+00 -0.867857D+00 -0.108325D+01  0.735013D+00
      3  -0.831224D+00  0.401790D+00  0.147060D+01  0.735013D+00 -0.133838D+01
               136           137           138           139           140 
      1  -0.277657D+00  0.188217D+00  0.124910D+01 -0.344482D+00 -0.371117D+00
      2   0.188217D+00 -0.672548D+00 -0.411208D+00 -0.371117D+00  0.326186D+00
      3   0.124910D+01 -0.411208D+00 -0.135220D+01  0.198028D+00  0.799001D+00
               141           142           143           144           145 
      1   0.198028D+00  0.169837D+01 -0.222541D+00 -0.147488D+01 -0.276682D+01
      2   0.799001D+00 -0.222541D+00  0.147863D+01  0.106267D+01  0.264598D+01
      3  -0.924022D+00 -0.147488D+01  0.106267D+01  0.901862D+01  0.258502D+00
               146           147           148           149           150 
      1   0.264598D+01  0.258502D+00  0.277180D+01 -0.302555D+01 -0.481023D+00
      2  -0.361739D+01 -0.742461D+00 -0.302555D+01  0.727583D+01  0.509034D+00
      3  -0.742461D+00 -0.848763D+00 -0.481023D+00  0.509034D+00  0.106980D+01
               151           152           153           154           155 
      1  -0.812385D+00  0.566901D+00 -0.397163D+00  0.374216D+01  0.235720D+01
      2   0.566901D+00 -0.114041D+01  0.899813D+00  0.235720D+01  0.266549D+01
      3  -0.397163D+00  0.899813D+00  0.604968D+00  0.251347D+01  0.145450D+01
               156           157           158           159           160 
      1   0.251347D+01  0.148363D+01  0.211092D+01  0.909286D+00  0.240661D+01
      2   0.145450D+01  0.211092D+01  0.298487D+01  0.183570D+01  0.136656D+01
      3   0.237844D+01  0.909286D+00  0.183570D+01  0.186112D+01  0.219315D+01
               161           162           163           164           165 
      1   0.136656D+01  0.219315D+01 -0.483802D+01 -0.176106D+01 -0.321235D+01
      2   0.215470D+01  0.240756D+01 -0.176106D+01 -0.218977D+01 -0.120483D+01
      3   0.240756D+01  0.352253D+01 -0.321235D+01 -0.120483D+01 -0.315363D+01
               166           167           168           169           170 
      1  -0.530678D+00 -0.883917D+00 -0.163799D+00 -0.288084D+01 -0.778305D+00
      2  -0.883917D+00 -0.491136D+00 -0.391477D+00 -0.778305D+00 -0.989430D+00
      3  -0.163799D+00 -0.391477D+00 -0.355243D+00 -0.237888D+01 -0.150688D+01
               171           172           173           174           175 
      1  -0.237888D+01 -0.704588D+00 -0.110012D+01  0.705840D-02 -0.997098D+00
      2  -0.150688D+01 -0.110012D+01 -0.965471D+00  0.417914D+00 -0.826021D+00
      3  -0.337622D+01  0.705840D-02  0.417914D+00 -0.439568D+00  0.302863D+00
               176           177           178           179           180 
      1  -0.826021D+00  0.302863D+00  0.666269D+00  0.819522D+00 -0.296508D+00
      2  -0.550186D+01  0.194521D+01  0.819522D+00  0.414906D+01 -0.189947D+01
      3   0.194521D+01 -0.178718D+01 -0.296508D+00 -0.189947D+01  0.261986D+01
               181           182           183           184           185 
      1   0.291610D+01 -0.152932D+01 -0.205706D+01 -0.986860D+00  0.123986D+01
      2  -0.152932D+01  0.272585D+01  0.167298D+01  0.123986D+01 -0.196018D+01
      3  -0.205706D+01  0.167298D+01  0.241324D+01  0.804395D+00 -0.940644D+00
               186           187           188           189           190 
      1   0.804395D+00 -0.199453D+01  0.979981D+00  0.136774D+01  0.104332D+01
      2  -0.940644D+00  0.979981D+00 -0.171512D+01 -0.205219D+01  0.751401D+00
      3  -0.124796D+01  0.136774D+01 -0.205219D+01 -0.320391D+01 -0.914459D+00
               191           192           193           194           195 
      1   0.751401D+00 -0.914459D+00  0.164143D+01  0.398701D+00 -0.437534D+00
      2   0.334901D+00 -0.249002D+00  0.398701D+00  0.891893D+00 -0.128924D+01
      3  -0.249002D+00  0.129775D+01 -0.437534D+00 -0.128924D+01  0.180635D+01
               196           197           198           199           200 
      1  -0.221087D+01 -0.102881D+00  0.188759D+01  0.127898D+01 -0.115242D+01
      2  -0.102881D+00 -0.167436D+01  0.150165D+01 -0.115242D+01  0.114516D+01
      3   0.188759D+01  0.150165D+01 -0.486881D+01  0.440025D-01  0.242964D+00
               201           202           203           204           205 
      1   0.440025D-01 -0.296307D+01  0.278198D+01  0.558795D+00  0.434164D-01
      2   0.242964D+00  0.278198D+01 -0.714600D+01 -0.114425D+01  0.382266D+00
      3   0.382713D+00  0.558795D+00 -0.114425D+01 -0.116902D+01  0.716015D+00
               206           207           208           209           210 
      1   0.382266D+00  0.716015D+00  0.721538D+01  0.797978D+00  0.248039D+01
      2  -0.975335D+00 -0.765000D+00  0.797978D+00  0.108532D+01  0.229303D+00
      3  -0.765000D+00 -0.708692D+00  0.248039D+01  0.229303D+00  0.177125D+01
               211           212           213           214           215 
      1   0.234349D+01  0.135564D+01  0.681438D+00  0.496798D+01  0.339817D+00
      2   0.135564D+01  0.212033D+00  0.352128D+00  0.339817D+00  0.768183D+00
      3   0.681438D+00  0.352128D+00  0.904727D+00  0.244964D+01  0.557534D+00
               216           217           218           219           220 
      1   0.244964D+01 -0.435654D+01  0.195326D-01  0.212393D+01  0.148886D+00
      2   0.557534D+00  0.195326D-01 -0.135244D+01  0.937766D+00 -0.613084D+00
      3   0.212422D+01  0.212393D+01  0.937766D+00 -0.293405D+01  0.355447D+00
               221           222           223           224           225 
      1  -0.613084D+00  0.355447D+00  0.192472D+01  0.312165D+00 -0.146089D+01
      2  -0.532472D+00  0.288950D+00  0.312165D+00  0.436906D+00 -0.184153D+00
      3   0.288950D+00  0.222681D+00 -0.146089D+01 -0.184153D+00  0.274937D+01
               226           227           228           229           230 
      1   0.344664D+01  0.134655D+00  0.323131D+01  0.116236D+01  0.774294D+00
      2   0.134655D+00  0.113127D+01 -0.359506D-01  0.774294D+00  0.997838D-01
      3   0.323131D+01 -0.359506D-01  0.399803D+01  0.971829D+00  0.636303D+00
               231           232           233           234           235 
      1   0.971829D+00  0.261542D+01  0.103219D+00  0.291818D+01  0.624325D+00
      2   0.636303D+00  0.103219D+00  0.678705D+00  0.302641D+00 -0.109971D+01
      3   0.202645D+01  0.291818D+01  0.302641D+00  0.567281D+01  0.577409D+00
               236           237           238           239           240 
      1  -0.109971D+01  0.577409D+00 -0.144107D+01  0.158963D+01 -0.267628D+00
      2   0.140079D+01 -0.179837D+00  0.158963D+01 -0.833794D+01  0.118555D+01
      3  -0.179837D+00  0.567568D+00 -0.267628D+00  0.118555D+01 -0.160290D+01
               241           242           243 
      1   0.848095D-01  0.224660D+00  0.256839D+00
      2   0.224660D+00 -0.776295D+00 -0.489868D+00
      3   0.256839D+00 -0.489868D+00 -0.178304D+00
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.125205D+01  0.971306D+00  0.161888D+01  0.225265D+01 -0.549836D+01
      2   0.858888D+01 -0.167174D+00  0.373014D+01  0.161522D+01 -0.398631D+01
      3   0.931674D+00 -0.652423D+01 -0.185020D+01  0.102417D+01  0.681453D+01
                 6             7             8             9            10 
      1  -0.353965D+01  0.406732D+01  0.370465D+01  0.167660D+01 -0.422595D+01
      2   0.273798D+01 -0.307355D+01  0.305740D+01 -0.251092D+01 -0.202042D+01
      3   0.263399D+01 -0.215701D+01  0.276028D+01 -0.324841D+01 -0.223232D+01
                11            12            13            14            15 
      1  -0.266392D+01  0.122045D+01  0.129798D+01  0.446207D+01 -0.106590D+02
      2  -0.324267D+01  0.204823D+01 -0.321488D+01 -0.350709D+00  0.126607D+01
      3  -0.326767D+01  0.370556D+01  0.681718D+01  0.414941D+00  0.124520D+01
                16            17            18            19            20 
      1  -0.514837D+01  0.153896D+00 -0.244786D+01  0.435189D+01  0.410221D+01
      2  -0.595790D+01  0.370690D+01 -0.563581D+01  0.507405D+01 -0.112712D+01
      3   0.335880D+01  0.277599D+01 -0.207002D+00 -0.379604D+00 -0.434789D+01
                21            22            23            24            25 
      1   0.411413D+01 -0.704663D+00  0.163823D+01  0.513154D+01  0.461667D+01
      2   0.112021D+02 -0.755895D+00 -0.657243D+00 -0.766703D+01  0.382944D+01
      3   0.394533D+00  0.578635D+00 -0.209797D+00 -0.155431D+01  0.745782D+00
                26            27            28            29            30 
      1   0.958326D+01 -0.981586D+00 -0.496938D+01 -0.640742D+01 -0.106131D+01
      2  -0.741038D+01  0.664851D+00 -0.211821D+01 -0.188243D+01  0.491759D+01
      3  -0.170395D+01  0.521342D+00 -0.848083D+01 -0.124370D+02  0.581639D+01
                31            32            33            34            35 
      1  -0.579838D+01 -0.199526D+01 -0.104277D+02 -0.370569D+00 -0.483999D+01
      2  -0.533780D+00  0.471155D+01  0.289406D+01  0.565193D+00  0.209445D+01
      3  -0.356170D+01  0.119642D+02  0.529269D+00  0.525537D+01  0.154605D+01
                36            37            38            39            40 
      1   0.608710D+01  0.368079D+01  0.946463D+00  0.508635D+00  0.473237D+00
      2  -0.416181D+01 -0.550262D+01 -0.103288D+01  0.418856D+01 -0.107730D+01
      3  -0.150469D+01  0.489886D+01 -0.251803D+01 -0.374813D+01  0.555319D+01
                41            42            43            44            45 
      1   0.504823D+01  0.863244D+00 -0.604689D+00  0.815171D+01 -0.722647D+01
      2   0.173774D+01 -0.128865D+01 -0.247245D+01 -0.678898D+00  0.310519D+01
      3  -0.895468D+01 -0.152764D+01 -0.328735D+01 -0.167358D+01 -0.386370D+00
                46            47            48            49            50 
      1   0.319375D+01  0.188185D+01  0.481338D+01  0.387395D+01 -0.131871D+02
      2  -0.297425D+01  0.657773D+01 -0.295717D+01  0.564264D+01 -0.324649D+01
      3  -0.261724D+00  0.207419D+01 -0.609038D+01  0.572818D+01  0.242592D+01
                51            52            53            54            55 
      1  -0.162091D+01  0.128868D+01  0.103329D+02  0.140170D+02 -0.480981D+01
      2  -0.997848D+00 -0.105356D+02  0.102130D+01  0.548573D+01  0.232034D+01
      3  -0.225715D+01 -0.654315D+01 -0.263651D+01  0.398034D+00 -0.472045D+01
                56            57            58            59            60 
      1   0.612059D+01 -0.236464D+01  0.461496D+01 -0.533501D+01 -0.605883D+01
      2   0.900865D+00 -0.384658D+01  0.888220D+00 -0.625827D+01 -0.189095D+01
      3   0.351129D+01  0.491769D+01  0.662362D+01  0.114527D+01  0.101965D+01
                61            62            63            64            65 
      1  -0.492507D+00  0.492574D+01  0.112945D+02  0.675022D+01 -0.157793D+01
      2  -0.772379D+01  0.209257D+00  0.770079D+01 -0.215807D+01  0.450092D+01
      3   0.346187D+01 -0.464539D+00  0.270325D+01 -0.188515D+01 -0.907353D+01
                66            67            68            69            70 
      1   0.365315D+01 -0.267019D+01 -0.683106D+01  0.765540D+01  0.293025D+01
      2   0.774136D+01  0.273160D+01  0.189338D+01 -0.393018D+01  0.251100D+01
      3  -0.127592D+02 -0.193541D+01  0.166018D+01  0.806197D+00 -0.104342D+02
                71            72            73            74            75 
      1   0.146190D+02 -0.237634D+01 -0.124676D+00 -0.697558D+00 -0.470859D+01
      2  -0.528988D+01  0.704185D+00  0.341295D+01  0.944506D+00  0.132684D+02
      3  -0.115592D+00  0.872295D-01 -0.313076D+01 -0.145923D+02 -0.360394D+00
                76            77            78            79            80 
      1  -0.264930D+01  0.238382D+01 -0.152171D+01  0.973324D+00 -0.129339D+01
      2  -0.130791D+01  0.285524D+01  0.356701D+01  0.422073D+01  0.502744D+00
      3  -0.304875D+01 -0.761560D+01  0.249159D-01  0.506563D+00  0.686101D+00
                81            82            83            84            85 
      1  -0.510464D+01 -0.222345D+01  0.995061D-01 -0.184658D+01  0.230418D-01
      2  -0.159890D+01 -0.115349D+02 -0.621961D+00 -0.515631D+01 -0.194254D+01
      3  -0.262403D+01  0.562259D+01  0.398035D+01  0.304663D+01  0.117429D+02
                86            87            88            89            90 
      1   0.693506D+00 -0.463523D+01 -0.376445D+01 -0.495470D+00  0.304732D+01
      2   0.552686D+01 -0.792357D+01 -0.125126D+02 -0.721359D+01  0.838225D+01
      3  -0.149363D+02 -0.585623D+01  0.436297D+01 -0.558660D+01  0.976496D+01
                91            92            93            94            95 
      1  -0.858374D+01 -0.418735D+01 -0.361631D+01 -0.605855D+01  0.158495D+02
      2  -0.101051D+02 -0.477500D+00  0.127270D+02 -0.135606D+00  0.485389D+01
      3  -0.293670D+01 -0.858147D-01  0.867997D+01  0.443464D+01 -0.376193D+01
                96            97            98            99           100 
      1  -0.541426D+01 -0.378814D+01  0.270331D+01 -0.860318D+01  0.499069D+00
      2  -0.100612D+01  0.628660D+01 -0.159521D+01  0.273619D+01  0.649260D+01
      3   0.917540D-01  0.709302D+01 -0.131246D+01  0.481908D+01  0.103033D+01
               101           102           103           104           105 
      1  -0.480091D+01 -0.229360D+01 -0.428250D+00  0.404949D+01 -0.178984D+00
      2  -0.145825D+01 -0.296791D+01 -0.269505D+01  0.132693D+01  0.161541D+01
      3  -0.145114D+01 -0.881155D+00  0.727813D+00  0.307145D+00  0.240133D+00
               106           107           108           109           110 
      1  -0.169251D+01  0.522569D+01  0.329674D+01 -0.243174D+00  0.402916D+01
      2  -0.599970D+01  0.140710D+01  0.329986D+01 -0.109501D+02  0.145904D+01
      3  -0.345152D+00  0.135099D+01  0.647285D+00 -0.300595D+01 -0.195130D+01
               111           112           113           114           115 
      1  -0.249772D+00  0.106439D+01 -0.169147D+01 -0.395787D+00  0.143030D+00
      2  -0.403943D+01  0.232487D+01 -0.172580D+01  0.186570D+01 -0.542163D+01
      3  -0.162814D+01  0.147660D+01  0.157561D+00  0.576990D+00 -0.148249D+01
               116           117           118           119           120 
      1   0.190250D+01  0.413845D+00 -0.457232D+00  0.306066D+01  0.306132D+01
      2   0.153123D+01 -0.347154D+01 -0.199542D+01  0.223169D+01  0.872776D-01
      3  -0.544125D+00 -0.135376D+01 -0.492622D+01  0.605756D+01 -0.167469D+01
               121           122           123           124           125 
      1   0.188983D+01 -0.562448D+01 -0.449695D+01  0.998135D+00  0.169324D+00
      2   0.216264D+01 -0.336032D+01  0.467438D+00 -0.141710D+01  0.990858D+00
      3   0.778066D+01 -0.100645D+02  0.142620D+01 -0.912504D+00  0.735459D+00
               126           127           128           129           130 
      1  -0.695630D+00  0.270116D+01 -0.941976D+00 -0.477854D+01  0.198764D+00
      2  -0.263037D+00  0.625348D+01  0.137094D+01  0.189953D+01  0.922570D+00
      3  -0.189280D+01  0.146641D+02  0.113873D+01 -0.362540D+01  0.295336D+01
               131           132           133           134           135 
      1   0.449444D+00 -0.897315D+00 -0.265427D+01  0.135286D+01  0.189435D+01
      2   0.651777D+00  0.209455D+00 -0.217983D+01 -0.452149D+00 -0.281706D+00
      3   0.103927D+01 -0.103193D+01 -0.408727D+01 -0.686437D+00  0.299786D+01
               136           137           138           139           140 
      1  -0.132780D+01  0.368131D+00  0.262104D+01  0.370225D+00 -0.134517D+01
      2  -0.123756D+01  0.643894D+00  0.148304D+01  0.635410D+00 -0.163484D+00
      3   0.299049D+00 -0.206741D+01  0.764808D+00 -0.278882D-01 -0.133001D+01
               141           142           143           144           145 
      1   0.370383D+01  0.254414D+01  0.173853D+01 -0.170353D+02  0.334843D+01
      2   0.222865D+01 -0.319545D+01 -0.100766D+01 -0.993325D+01  0.334559D+01
      3   0.951678D+00  0.253285D+01  0.192807D+01 -0.249078D+01 -0.117094D+01
               146           147           148           149           150 
      1  -0.658631D+01  0.211092D+00 -0.399989D+01  0.109488D+02 -0.256666D+01
      2  -0.344280D+01  0.222298D+01 -0.385622D+01  0.531537D+01 -0.111098D+01
      3  -0.228738D+01 -0.884508D+00  0.387410D+01  0.452517D+01 -0.536747D+00
               151           152           153           154           155 
      1   0.105215D+01 -0.318421D+01  0.639651D+00 -0.203632D+01  0.140681D+01
      2   0.781603D+00 -0.177312D+01  0.605875D+00 -0.204135D+01 -0.590011D+00
      3  -0.129273D+01 -0.124564D+01  0.350720D+00  0.516445D+01 -0.715019D+00
               156           157           158           159           160 
      1  -0.354851D+01 -0.326067D+00 -0.105058D+00 -0.377314D+01 -0.185564D+01
      2   0.179966D+01 -0.149606D+01 -0.335442D+00  0.133854D+01 -0.218475D+01
      3   0.275815D+01  0.293390D+01  0.621392D+00  0.496777D+00  0.381447D+01
               161           162           163           164           165 
      1   0.484681D+00 -0.401461D+01 -0.410012D+01  0.159854D+01 -0.577755D+01
      2   0.992031D+00  0.214486D+01 -0.533724D+01 -0.887472D+00  0.462411D+00
      3  -0.770105D+00  0.138226D+01  0.108070D+02 -0.499068D+00  0.619798D+01
               166           167           168           169           170 
      1   0.783743D-01 -0.262537D+00 -0.141791D+01 -0.414097D+01  0.597731D-01
      2  -0.492448D+00 -0.101588D+01 -0.492251D-01 -0.363609D+01 -0.141905D+00
      3   0.145167D+01  0.164343D+01  0.727677D+00  0.658536D+01  0.324435D+00
               171           172           173           174           175 
      1  -0.506814D+01  0.125294D+01  0.198916D+01 -0.123248D+01  0.182841D+01
      2  -0.549232D-02 -0.525993D+00 -0.159547D+01  0.117818D+01 -0.712645D+00
      3   0.457391D+01  0.859944D+00  0.626594D+00 -0.135087D-01  0.378497D+01
               176           177           178           179           180 
      1   0.108562D+02 -0.954095D+01 -0.839189D+00 -0.821815D+01  0.110850D+02
      2  -0.267196D+01  0.211823D+01 -0.366639D+00  0.247097D+01 -0.331280D+01
      3  -0.203281D+01  0.772050D+00 -0.262858D+01  0.150764D+01 -0.111610D+01
               181           182           183           184           185 
      1  -0.253683D+01 -0.169144D+01  0.397298D+01  0.275933D+00  0.449015D+00
      2   0.712989D+01 -0.272485D+01 -0.257889D+01 -0.212917D+01  0.206835D+01
      3  -0.972777D+01  0.301986D+01  0.539834D+01  0.431642D+01 -0.313487D+01
               186           187           188           189           190 
      1  -0.293753D+01  0.172020D+01 -0.143133D+00 -0.398613D+01 -0.100740D+01
      2   0.141386D+01 -0.523771D+01  0.235305D+01  0.282915D+01 -0.205966D+01
      3  -0.239800D+01  0.602442D+01 -0.217324D+01 -0.418537D+01 -0.222602D+01
               191           192           193           194           195 
      1  -0.566138D+00  0.614971D+00 -0.453154D-02 -0.218214D+01  0.122806D+01
      2  -0.276370D+00  0.359284D+01  0.630968D+00 -0.423979D+01  0.650137D+01
      3  -0.176826D+01  0.138680D+01 -0.500933D-01 -0.438112D+01  0.463237D+01
               196           197           198           199           200 
      1   0.709633D+00  0.447318D+01 -0.359248D+01  0.339735D+00 -0.477968D+00
      2   0.647760D+00  0.572431D+01 -0.153608D+02  0.287709D+00  0.307503D+00
      3   0.646713D+00  0.663606D+01 -0.605733D+01  0.258260D+01 -0.337698D+01
               201           202           203           204           205 
      1   0.454847D+00 -0.694012D-01  0.145309D+01 -0.345924D+01  0.277334D+00
      2   0.167745D+01  0.563952D+00 -0.318050D+01 -0.433755D+01  0.687128D+00
      3  -0.694691D+00 -0.186951D+01  0.198496D+02  0.305158D+01 -0.793581D+00
               206           207           208           209           210 
      1   0.780967D+00 -0.624908D+00  0.174055D+01  0.844238D+00  0.880884D+00
      2  -0.167840D+01 -0.203737D+01  0.776424D+01  0.129080D+01  0.836048D+01
      3   0.322611D+01  0.156667D+01 -0.648012D+01 -0.588136D+01 -0.249067D+01
               211           212           213           214           215 
      1   0.619048D+00  0.682345D+00 -0.300060D+00  0.188838D+01  0.166505D+01
      2   0.194551D+01  0.971780D+00  0.352476D+01  0.523092D+01  0.180293D+01
      3  -0.341609D+01 -0.194311D+01 -0.118438D+01 -0.373705D+01 -0.380496D+01
               216           217           218           219           220 
      1   0.826847D+00  0.422440D+01 -0.367492D+01 -0.237894D+01 -0.159950D+01
      2   0.751601D+01  0.148989D+02 -0.693207D+00 -0.472557D+01 -0.628568D+00
      3  -0.319312D+01  0.799279D+01 -0.177380D+01 -0.323367D+01  0.612547D+00
               221           222           223           224           225 
      1   0.179373D-01 -0.760253D-01 -0.195739D+01  0.193357D+01  0.279722D+01
      2   0.198289D+01 -0.509931D+00 -0.741075D+01 -0.533576D+00  0.438935D+01
      3   0.112433D+01 -0.749345D+00 -0.328844D+01  0.145378D+00  0.219737D+01
               226           227           228           229           230 
      1   0.469626D+01  0.409608D+01  0.508290D+01  0.261472D+01  0.176916D+01
      2  -0.498504D+01 -0.864042D+00 -0.414097D+00 -0.214464D+01 -0.798773D+00
      3  -0.388721D+01 -0.323204D+01 -0.364311D+01 -0.125209D+01 -0.145065D+01
               231           232           233           234           235 
      1   0.262803D+01  0.407375D+01  0.415696D+01  0.776905D+01 -0.138536D+01
      2   0.661230D+00 -0.565359D+01  0.108231D-01  0.918767D-01 -0.156049D+00
      3  -0.155312D+01 -0.358782D+01 -0.190130D+01 -0.403749D+01  0.960381D-01
               236           237           238           239           240 
      1   0.275914D+01  0.102816D+01  0.296657D+01 -0.174627D+02 -0.378778D+01
      2   0.162592D+01  0.594230D+00  0.305912D+01 -0.190478D+01 -0.169771D+01
      3  -0.951118D+00 -0.261242D+00  0.349399D+01  0.662440D+01 -0.709178D+00
               241           242           243 
      1   0.528011D+00 -0.155042D+01 -0.231573D+01
      2  -0.528243D+00 -0.602589D+00 -0.951155D+00
      3   0.189093D+00  0.996475D+00  0.287263D+00
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.823325D+01  0.332030D+01  0.125751D+02  0.451096D+01  0.684122D+01
      2  -0.128628D+01 -0.257406D+01 -0.832885D+01 -0.391741D+01 -0.123340D+01
      3   0.951954D+01 -0.746245D+00 -0.424626D+01 -0.593556D+00 -0.560782D+01
      4  -0.904802D-01  0.408204D+01 -0.439681D+01  0.549250D+01 -0.110975D+02
      5   0.114899D+02 -0.878691D+00  0.762365D+01  0.850820D+00  0.446610D+00
      6  -0.670137D+01  0.220054D+01 -0.128153D+01  0.266324D+01 -0.456741D+01
                 6             7             8             9            10 
      1  -0.367071D+01  0.158433D+02 -0.237177D+01  0.877512D+01  0.108638D+01
      2  -0.336395D+01 -0.892783D+01 -0.156342D+01 -0.457752D+01 -0.835596D+00
      3   0.703466D+01 -0.691552D+01  0.393519D+01 -0.419760D+01 -0.250784D+00
      4  -0.371282D+00 -0.371514D+01  0.141671D+00  0.168256D+01  0.516172D+01
      5   0.532705D+01  0.883742D+01  0.456022D+01 -0.103929D+01 -0.143261D+01
      6  -0.309994D+01 -0.136438D+01 -0.364455D+01  0.269176D+01  0.646398D+01
                11            12            13            14            15 
      1   0.462662D+01  0.140197D+01  0.673594D+01 -0.112178D+01 -0.115814D+02
      2  -0.181666D+01  0.344579D+01  0.129582D+00  0.712018D+01 -0.285266D+01
      3  -0.280996D+01 -0.484776D+01 -0.686553D+01 -0.599840D+01  0.144341D+02
      4   0.325784D+01  0.312434D+01  0.383692D+00  0.157150D+01 -0.116013D+01
      5  -0.151813D+01  0.421601D+01 -0.171313D+01 -0.165995D+01 -0.379882D+01
      6  -0.153019D+01  0.656524D+00 -0.543356D+00  0.346460D+01 -0.324088D+01
                16            17            18            19            20 
      1  -0.128475D+02 -0.642829D+01 -0.201331D+01  0.629501D+01 -0.260258D+01
      2   0.477674D+01 -0.275192D+01  0.254625D+00  0.111108D+02 -0.994126D+01
      3   0.807080D+01  0.918021D+01  0.175868D+01 -0.174058D+02  0.125438D+02
      4   0.586892D+01 -0.399880D+01  0.208905D+01  0.397898D+01 -0.231199D+01
      5   0.234397D+01 -0.229171D+00  0.441828D+00 -0.914545D+01  0.280090D+01
      6  -0.252938D-02  0.753812D+00  0.992657D+01  0.398999D+01 -0.852318D+00
                21            22            23            24            25 
      1  -0.800881D+01 -0.982929D+01 -0.574354D+01  0.123129D+02 -0.162034D+01
      2  -0.383080D+01 -0.645343D+01 -0.481410D+01  0.125623D+01 -0.518672D+01
      3   0.118396D+02  0.162827D+02  0.105576D+02 -0.135691D+02  0.680706D+01
      4   0.305809D+01 -0.216351D+01 -0.261599D+01 -0.160197D+01  0.138643D+01
      5  -0.193523D+02  0.479288D+01  0.226229D+01  0.106181D+02 -0.129256D+02
      6   0.939612D+01 -0.245127D+01 -0.437846D+01  0.606467D+01  0.686011D+01
                26            27            28            29            30 
      1   0.629019D+01  0.291390D+01 -0.458425D+01 -0.147969D+02  0.558445D+01
      2   0.725875D+00  0.110115D+02 -0.589549D+01  0.233213D+02  0.475594D+00
      3  -0.701607D+01 -0.139254D+02  0.104797D+02 -0.852436D+01 -0.606005D+01
      4  -0.166897D+01  0.344449D+01 -0.167976D+02 -0.113172D+02  0.112936D+02
      5   0.709225D+01  0.282318D+01  0.110162D+02  0.746519D+01 -0.296621D+01
      6   0.425645D+01 -0.458000D+01  0.138691D+02 -0.106495D+01 -0.453539D+01
                31            32            33            34            35 
      1  -0.923507D+01  0.146933D+02 -0.182626D+00  0.458676D+01  0.124401D+01
      2   0.156914D+02 -0.218965D+02  0.808551D+01  0.547468D+00  0.685334D+01
      3  -0.645630D+01  0.720319D+01 -0.790288D+01 -0.513422D+01 -0.809734D+01
      4  -0.341410D+01  0.113464D+02  0.146566D+01  0.934394D+01  0.323808D+01
      5   0.278442D+01 -0.316961D+01  0.198594D+00 -0.381376D+01  0.540110D+00
      6  -0.150196D+01  0.860816D+01  0.131740D+01 -0.280270D+01  0.293866D+01
                36            37            38            39            40 
      1  -0.742861D+01  0.472011D+00  0.374646D+01 -0.336034D+00  0.244509D+01
      2   0.529610D+01  0.167169D+01 -0.840046D+01 -0.277920D+01 -0.518595D+01
      3   0.213251D+01 -0.214370D+01  0.465400D+01  0.311524D+01  0.274086D+01
      4   0.242393D+01  0.393827D+00 -0.672269D+01 -0.105402D+02 -0.586251D+01
      5  -0.122778D+01 -0.518210D+01 -0.798055D+01 -0.879718D+01 -0.431380D+01
      6  -0.887748D+01 -0.116236D+02 -0.101662D+02 -0.366690D+01 -0.753103D+01
                41            42            43            44            45 
      1  -0.787655D+01 -0.723227D-01 -0.282937D+01 -0.874085D+00  0.229095D+01
      2   0.113148D+02 -0.780106D+00  0.421508D+00 -0.916862D+00 -0.723171D+01
      3  -0.343829D+01  0.852428D+00  0.240787D+01  0.179095D+01  0.494075D+01
      4  -0.321554D+01 -0.492256D+01 -0.837676D+01 -0.488870D+01 -0.105870D+02
      5  -0.503165D+01 -0.671198D+01 -0.731921D+01 -0.855385D+01 -0.535645D+01
      6   0.318702D+00 -0.749641D+01 -0.603767D+01 -0.106400D+02  0.173023D+01
                46            47            48            49            50 
      1  -0.513974D+02 -0.615701D+01  0.345216D+01 -0.182507D+02  0.131995D+01
      2   0.243133D+02 -0.206920D+01 -0.359091D+01  0.876467D+01 -0.361689D+01
      3   0.270841D+02  0.822621D+01  0.138756D+00  0.948599D+01  0.229694D+01
      4  -0.129556D+02 -0.850613D+01  0.151378D+01  0.724123D+00 -0.427648D+01
      5   0.549835D+01  0.356296D+01 -0.799127D+01  0.279765D+01  0.168987D+00
      6   0.639789D+00  0.667410D+00 -0.566613D+01  0.319876D+01 -0.493356D+01
                51            52            53            54            55 
      1   0.115421D+02  0.107504D+01  0.949927D+01 -0.654530D+00  0.216106D+01
      2  -0.699245D+00  0.175929D+01 -0.555698D+01 -0.191907D+01 -0.637930D+01
      3  -0.108429D+02 -0.283433D+01 -0.394229D+01  0.257360D+01  0.421824D+01
      4   0.154198D+01 -0.977868D+00  0.341490D+01 -0.267880D+01  0.249651D+01
      5  -0.487025D+01  0.452611D+01 -0.926263D+00 -0.654718D+00 -0.165399D+01
      6  -0.281821D+01 -0.283412D+00  0.569843D+00 -0.609485D+01  0.353895D+01
                56            57            58            59            60 
      1  -0.736102D+01 -0.675715D+01  0.167572D+01 -0.199511D+01 -0.826923D+01
      2   0.162311D+02  0.183914D+01  0.869198D+01 -0.112424D+02 -0.266311D+00
      3  -0.887008D+01  0.491801D+01 -0.103677D+02  0.132375D+02  0.853554D+01
      4  -0.124648D+02  0.156600D+00 -0.800893D+01  0.173054D+02 -0.106353D+01
      5  -0.153876D+01 -0.512621D-01 -0.126886D+00  0.317600D+01  0.818651D-01
      6   0.942751D+01  0.346191D+01  0.354202D+01  0.120274D+01  0.870708D+01
                61            62            63            64            65 
      1   0.236527D+01 -0.282420D+01  0.977200D+01  0.561502D+01 -0.535263D+01
      2  -0.538263D+01  0.805313D+01  0.148520D+02  0.394593D+01  0.233347D+01
      3   0.301736D+01 -0.522892D+01 -0.246240D+02 -0.956095D+01  0.301916D+01
      4   0.328832D+01 -0.315903D+01  0.594366D+01 -0.530250D+01 -0.881765D+01
      5   0.603764D+00  0.927346D+00  0.130011D+02 -0.872571D+01 -0.789208D+01
      6   0.123061D+01  0.543130D+01 -0.828492D+01 -0.200070D+02  0.746173D+01
                66            67            68            69            70 
      1  -0.932925D+01 -0.487855D+01 -0.147289D+01 -0.207549D+01 -0.752890D+01
      2   0.110491D+02  0.125605D+01 -0.421886D+01  0.167354D+02  0.100953D+02
      3  -0.171986D+01  0.362249D+01  0.569175D+01 -0.146599D+02 -0.256639D+01
      4  -0.181689D+02 -0.609611D+01  0.161916D+01  0.833002D+01 -0.157817D+02
      5  -0.170973D+02 -0.396718D+01  0.672514D+01  0.346830D+00 -0.141671D+02
      6  -0.465793D+00  0.696960D+01  0.131963D+02 -0.621418D+01 -0.381795D+00
                71            72            73            74            75 
      1  -0.535234D+01  0.317480D+01  0.104015D+03  0.130717D+02 -0.412348D+01
      2   0.198709D+02 -0.736643D+01 -0.504869D+02 -0.326564D+01  0.311646D+01
      3  -0.145185D+02  0.419163D+01 -0.535280D+02 -0.980602D+01  0.100702D+01
      4   0.933759D+01 -0.428438D+01  0.177688D+02  0.212543D+02 -0.985390D+00
      5  -0.850416D+00 -0.134705D+01 -0.880785D+01 -0.177317D+01  0.188771D+02
      6  -0.995279D+01 -0.615187D+01 -0.487216D+01 -0.261230D+01  0.350522D+01
                76            77            78            79            80 
      1   0.160751D+02  0.131415D+02 -0.315828D+01  0.186688D+01 -0.239547D+01
      2  -0.673468D+01 -0.121916D+01  0.188907D+01  0.168609D+01  0.108755D+01
      3  -0.934042D+01 -0.119224D+02  0.126921D+01 -0.355297D+01  0.130792D+01
      4   0.243296D+02  0.127379D+02 -0.282857D+01 -0.317993D+01 -0.202349D+01
      5  -0.482608D+01 -0.344014D+01  0.526966D+01  0.210531D+02  0.462693D+01
      6  -0.368622D+01 -0.188553D+01  0.550421D+01  0.249774D+01  0.442499D+01
                81            82            83            84            85 
      1   0.105592D+02 -0.469389D+01 -0.110787D+02 -0.236403D+02 -0.160409D+02
      2  -0.997933D+01  0.465655D+01  0.808982D+01  0.124531D+02  0.139873D+02
      3  -0.579844D+00  0.373310D-01  0.298889D+01  0.111872D+02  0.205365D+01
      4   0.394366D+01 -0.100002D+02 -0.587432D+01  0.107316D+01 -0.988401D+01
      5  -0.460132D+01 -0.239428D+02 -0.100099D+01 -0.104053D+02 -0.402680D+01
      6  -0.767397D+00  0.406117D+01  0.103738D+01  0.110375D+01  0.178849D+01
                86            87            88            89            90 
      1  -0.958159D+00 -0.849583D+00 -0.287541D+02 -0.748446D+00 -0.133600D+02
      2  -0.931911D+01 -0.247576D+01  0.146843D+02 -0.268958D+01  0.106199D+02
      3   0.102773D+02  0.332534D+01  0.140698D+02  0.343803D+01  0.274007D+01
      4   0.260378D+02  0.693000D+01 -0.113169D+01  0.661927D+01 -0.964582D+01
      5   0.703271D+01 -0.121301D+02 -0.149616D+02 -0.112430D+02  0.886866D+01
      6  -0.555000D+01  0.134826D+01  0.684836D+00  0.161822D+01 -0.837667D+00
                91            92            93            94            95 
      1   0.105235D+02 -0.246416D+01 -0.785908D+01 -0.363476D+01  0.354530D+01
      2   0.107819D+02  0.835270D+01  0.130427D+02  0.109260D+02 -0.231731D+02
      3  -0.213055D+02 -0.588854D+01 -0.518365D+01 -0.729128D+01  0.196278D+02
      4  -0.549140D+01 -0.173441D+01  0.641527D+01 -0.228913D+01  0.140709D+02
      5  -0.343816D+01 -0.221653D+01 -0.221159D+02 -0.498405D+01 -0.307079D+01
      6   0.472007D+01 -0.265572D+01 -0.307696D+01 -0.411023D+01  0.116752D+02
                96            97            98            99           100 
      1   0.492021D+01 -0.788803D+01  0.645502D+01 -0.931863D+01 -0.117525D+01
      2   0.738031D+01  0.132172D+02  0.605398D+00  0.137359D+02 -0.901702D+01
      3  -0.123005D+02 -0.532918D+01 -0.706042D+01 -0.441723D+01  0.101923D+02
      4   0.159670D+01  0.572707D+01  0.385927D+01 -0.229156D+01 -0.111163D+01
      5  -0.954607D+01 -0.203232D+02 -0.653813D+01 -0.962021D+01 -0.100083D+02
      6   0.801674D+01 -0.125457D+01  0.917815D+01 -0.952211D+01 -0.146903D+00
               101           102           103           104           105 
      1  -0.336523D+00  0.724545D+01  0.237792D+01 -0.292215D+01 -0.766979D+01
      2   0.382192D+01  0.113880D+02  0.327984D+01 -0.144878D+01 -0.652648D+01
      3  -0.348540D+01 -0.186335D+02 -0.565776D+01  0.437092D+01  0.141963D+02
      4   0.221215D+01 -0.273916D+00  0.177225D+01 -0.103841D+01 -0.123991D+01
      5   0.196747D+01  0.145538D+02  0.278132D+01 -0.360357D+01 -0.445729D+01
      6  -0.460789D+01 -0.789626D+00 -0.244823D+01  0.513287D+01  0.612335D+01
               106           107           108           109           110 
      1   0.383954D+01 -0.232813D+01 -0.169547D+02  0.362114D+01  0.198949D+01
      2   0.746209D+01 -0.337001D+01 -0.216355D+02 -0.118998D+02  0.900298D+00
      3  -0.113016D+02  0.569814D+01  0.385902D+02  0.827862D+01 -0.288979D+01
      4  -0.255428D+00 -0.138149D+01 -0.106964D+01 -0.887604D+01  0.559847D+01
      5   0.114811D+02 -0.310194D+01 -0.136842D+02  0.218326D+02 -0.484583D+01
      6  -0.984871D+00  0.577145D+01  0.123482D+01 -0.712069D+01  0.751303D+01
               111           112           113           114           115 
      1  -0.306078D+01  0.131112D+01 -0.172387D+01  0.229144D+01 -0.174070D+01
      2  -0.104946D+02  0.103301D+01  0.146970D+01  0.175239D+00 -0.612066D+01
      3   0.135554D+02 -0.234413D+01  0.254168D+00 -0.246668D+01  0.786136D+01
      4  -0.668593D+01  0.573266D+01 -0.268775D+01  0.348969D+01 -0.399125D+01
      5   0.200498D+02 -0.424849D+01  0.409899D+01 -0.455252D+01  0.130256D+02
      6  -0.902968D+01  0.527351D+01 -0.554260D+01  0.736788D+01 -0.566867D+01
               116           117           118           119           120 
      1   0.167485D+01 -0.704554D+01 -0.257635D+01  0.118135D+02 -0.378573D+01
      2   0.167551D+00 -0.117126D+02  0.825579D+01 -0.212400D+02  0.259474D+01
      3  -0.184240D+01  0.187581D+02 -0.567944D+01  0.942653D+01  0.119099D+01
      4   0.208528D+01 -0.484656D+01 -0.556088D+01  0.112497D+02 -0.297975D+01
      5  -0.391981D+01  0.132202D+02  0.124957D+01 -0.368102D+01  0.231618D+01
      6   0.522780D+01 -0.769611D+01 -0.511768D+01  0.851987D+01 -0.527648D+01
               121           122           123           124           125 
      1   0.654883D+01 -0.301979D+02  0.618041D+01 -0.133045D+01  0.361909D+01
      2  -0.107257D+02  0.546530D+02 -0.785427D+01  0.182520D+00 -0.307210D+01
      3   0.417688D+01 -0.244551D+02  0.167386D+01  0.114793D+01 -0.546991D+00
      4   0.909452D+01 -0.723415D+01  0.588834D+00 -0.154748D+01  0.398894D+00
      5  -0.298547D+01  0.232625D+01 -0.601209D+00  0.210612D+01 -0.614471D+00
      6   0.336734D+01 -0.200247D+02  0.110643D+02 -0.241064D+01  0.100415D+02
               126           127           128           129           130 
      1  -0.484697D+01  0.173907D+02  0.240435D+01 -0.147085D+01  0.150878D+01
      2   0.463661D+01 -0.267366D+01  0.553747D+01  0.731277D+00  0.292029D+01
      3   0.210356D+00 -0.147170D+02 -0.794182D+01  0.739571D+00 -0.442907D+01
      4  -0.214887D+01  0.294081D+02  0.193369D+02 -0.106606D+02  0.117290D+02
      5   0.932958D+00 -0.177728D+02 -0.861475D+01  0.103740D+02 -0.405804D+01
      6  -0.337937D+01 -0.131682D+02 -0.966677D+01  0.106427D+02 -0.517190D+01
               131           132           133           134           135 
      1  -0.144313D+01  0.768631D+00 -0.208660D+01  0.108218D+01  0.614370D+00
      2   0.848463D+01 -0.299920D+01  0.184464D+01 -0.261724D+01 -0.301841D+01
      3  -0.704149D+01  0.223057D+01  0.241965D+00  0.153506D+01  0.240404D+01
      4   0.891991D+01 -0.431197D+01 -0.835418D+01 -0.554542D+01  0.681482D+01
      5  -0.408351D+01  0.273687D+01  0.100733D+02  0.452963D+01 -0.696044D+01
      6  -0.722226D+01  0.447942D+01  0.795965D+01  0.678118D+01 -0.696775D+01
               136           137           138           139           140 
      1  -0.771453D+00  0.112399D+01 -0.530527D-01  0.206240D+01 -0.307782D+01
      2  -0.389516D+01 -0.116227D+01  0.430772D+01 -0.284165D+01  0.109144D+01
      3   0.466661D+01  0.382831D-01 -0.425467D+01  0.779246D+00  0.198638D+01
      4  -0.130233D+01  0.421028D+01  0.364706D+01  0.119937D+01 -0.228133D+01
      5  -0.497978D+01  0.155885D+01  0.103029D+02 -0.212250D+01 -0.191375D+01
      6   0.211682D+01 -0.233141D+01 -0.262724D+01 -0.105362D+01  0.175484D+01
               141           142           143           144           145 
      1   0.723730D-01 -0.108611D+01 -0.524778D+01 -0.230322D+02  0.597368D+01
      2   0.564903D+01  0.523127D+01  0.910300D+00 -0.216206D+02  0.511701D+01
      3  -0.572141D+01 -0.414516D+01  0.433748D+01  0.446527D+02 -0.110907D+02
      4  -0.114509D+01  0.388301D+01 -0.303621D+01 -0.670672D+01 -0.164140D+02
      5   0.326880D+01  0.957927D+01 -0.318748D+01 -0.203769D+02 -0.414123D+01
      6   0.441120D+01 -0.402079D+01  0.901065D+01  0.204924D+02  0.378621D+01
               146           147           148           149           150 
      1   0.301295D+00  0.154221D+01 -0.163923D+00 -0.126033D+02 -0.192037D+01
      2  -0.111151D+02 -0.132021D+01 -0.102318D+02  0.339876D+02  0.147036D+01
      3   0.108138D+02 -0.222006D+00  0.103957D+02 -0.213843D+02  0.450013D+00
      4   0.209675D+02  0.336696D+01  0.174436D+02 -0.277890D+02 -0.283713D+01
      5   0.567373D+01  0.414584D+01  0.432320D+01 -0.430498D+01 -0.327461D+01
      6  -0.686357D+01 -0.417426D+01 -0.570610D+01  0.119669D+02  0.685896D+01
               151           152           153           154           155 
      1   0.242373D+01 -0.253054D+00 -0.357169D+01  0.598323D+01 -0.625338D+00
      2   0.785678D+00 -0.555410D+01  0.148372D+01 -0.852626D+00  0.548978D+01
      3  -0.320941D+01  0.580716D+01  0.208797D+01 -0.513060D+01 -0.486444D+01
      4  -0.367946D+01  0.436341D+01 -0.386883D+01  0.156959D+02  0.148318D+02
      5   0.128282D+01 -0.251342D+01 -0.124626D+01  0.135318D+02  0.825197D+01
      6  -0.208403D+01  0.449691D+01  0.196218D+01  0.105651D+02  0.936904D+01
               156           157           158           159           160 
      1   0.952537D+00 -0.139988D+01 -0.538784D+01 -0.366471D+01  0.730338D+00
      2  -0.130405D+01  0.524404D+01  0.111734D+02  0.437191D+01 -0.159879D+01
      3   0.351510D+00 -0.384415D+01 -0.578556D+01 -0.707200D+00  0.868454D+00
      4   0.103757D+02  0.116987D+02  0.123868D+02  0.741244D+01  0.943083D+01
      5   0.119464D+02  0.556671D+01  0.718681D+01  0.550805D+01  0.115749D+02
      6   0.956994D+01  0.740506D+01  0.114901D+02  0.118836D+02  0.910354D+01
               161           162           163           164           165 
      1  -0.437005D+01 -0.554172D+01  0.897320D+01 -0.212447D+01  0.108320D+01
      2   0.366194D+01 -0.480661D+00 -0.899997D+01  0.531100D+01 -0.773399D+01
      3   0.708103D+00  0.602238D+01  0.267700D-01 -0.318653D+01  0.665079D+01
      4   0.865668D+01  0.101239D+02  0.201212D+02  0.124680D+02  0.137941D+02
      5   0.766968D+01  0.128858D+02  0.206342D+02  0.759676D+01  0.179204D+02
      6   0.140654D+02  0.157839D+02  0.138079D+02  0.911553D+01  0.132357D+02
               166           167           168           169           170 
      1  -0.844719D+00 -0.670422D+00 -0.106427D+01  0.206407D+01 -0.250960D+01
      2   0.320823D+01  0.249414D+01  0.143744D+01 -0.716396D+01  0.538752D+00
      3  -0.236351D+01 -0.182372D+01 -0.373167D+00  0.509990D+01  0.197085D+01
      4   0.637152D+01  0.463695D+01  0.288901D+01  0.120847D+02  0.513821D+01
      5   0.187155D+01  0.326162D+01  0.102209D+01  0.153394D+02  0.476795D+01
      6   0.374397D+01  0.269713D+01  0.523655D+01  0.958248D+01  0.102285D+02
               171           172           173           174           175 
      1  -0.405845D+01 -0.509533D+00  0.139638D-01  0.481955D+00 -0.320147D+00
      2  -0.631607D+01  0.303020D+01  0.441467D+01 -0.271890D+01  0.447526D+01
      3   0.103745D+02 -0.252066D+01 -0.442863D+01  0.223694D+01 -0.415512D+01
      4   0.961218D+01  0.444901D+01  0.842045D+01 -0.118783D+01  0.799242D+01
      5   0.146228D+02  0.493023D+00  0.378968D+00  0.369001D+01  0.433110D+00
      6   0.140669D+02  0.415958D+00 -0.148828D+01  0.171754D+01 -0.132416D+01
               176           177           178           179           180 
      1  -0.139861D+02  0.379739D+01  0.267333D+00  0.918642D+01 -0.358643D+01
      2   0.349005D+02 -0.128668D+02 -0.376728D+01 -0.231893D+02  0.931269D+01
      3  -0.209144D+02  0.906942D+01  0.349994D+01  0.140029D+02 -0.572626D+01
      4   0.935748D+01 -0.377605D+01 -0.464015D+01 -0.775209D+01  0.342457D+01
      5  -0.221133D+01  0.178996D+01  0.229660D+01  0.224216D+01 -0.270376D+01
      6  -0.585650D+01  0.961125D+01  0.113314D+01  0.818853D+01 -0.120052D+02
               181           182           183           184           185 
      1  -0.268423D+01  0.957982D+01  0.911751D+01  0.442440D+01 -0.839820D+01
      2   0.242381D+00 -0.105143D+02 -0.197263D+01 -0.495098D+01  0.105724D+02
      3   0.244185D+01  0.934494D+00 -0.714488D+01  0.526579D+00 -0.217421D+01
      4  -0.134588D+02  0.864807D+01  0.953002D+01  0.646781D+01 -0.644659D+01
      5  -0.931080D+01  0.541927D+01  0.863140D+01  0.290632D+01 -0.434780D+01
      6   0.109054D+02 -0.131977D+02 -0.136059D+02 -0.659028D+01  0.939571D+01
               186           187           188           189           190 
      1  -0.596000D+01  0.550360D+01 -0.858350D+01 -0.117597D+02  0.667955D+01
      2   0.347864D+01 -0.135318D+01  0.462644D+01  0.758132D+00 -0.547714D+01
      3   0.248137D+01 -0.415042D+01  0.395706D+01  0.110016D+02 -0.120241D+01
      4  -0.488635D+01  0.904574D+01 -0.538807D+01 -0.584255D+01  0.321017D+01
      5  -0.245436D+01  0.816281D+01 -0.294156D+01 -0.561726D+01 -0.538063D+01
      6   0.104509D+02 -0.765566D+01  0.144995D+02  0.170783D+02 -0.940874D+00
               191           192           193           194           195 
      1   0.389009D+01 -0.366865D+01  0.928112D+01 -0.190265D+00 -0.112126D+01
      2  -0.258232D+01  0.437635D+01 -0.602526D+01  0.933578D+00  0.281889D+01
      3  -0.130778D+01 -0.707696D+00 -0.325586D+01 -0.743313D+00 -0.169763D+01
      4   0.306920D+01 -0.205101D+01  0.349773D+01  0.340478D+01 -0.568350D+01
      5  -0.290292D+01  0.105095D+02 -0.400869D+01 -0.555641D+01  0.921050D+01
      6  -0.611131D+00 -0.193115D+00 -0.355535D+00 -0.167323D+01  0.208685D+01
               196           197           198           199           200 
      1  -0.105448D+02  0.735254D-01  0.438941D+01  0.664968D+01 -0.478423D+01
      2   0.805825D+01  0.231260D+01 -0.121436D+02 -0.584375D+00  0.550206D-01
      3   0.248650D+01 -0.238612D+01  0.775418D+01 -0.606531D+01  0.472921D+01
      4  -0.678435D+00 -0.797923D+01  0.624121D+01 -0.738958D+01  0.112634D+02
      5   0.149130D+02  0.717532D+01 -0.248785D+02  0.303272D+00  0.247518D+01
      6  -0.992012D+00  0.324202D+01  0.834954D+00  0.124255D+01 -0.126018D+01
               201           202           203           204           205 
      1   0.965195D+00 -0.108389D+02 -0.255656D+01  0.452298D+00  0.116676D+01
      2  -0.721558D+00 -0.110983D+01  0.200230D+02  0.158238D+01 -0.890096D+00
      3  -0.243637D+00  0.119487D+02 -0.174664D+02 -0.203468D+01 -0.276664D+00
      4   0.214528D+01  0.206651D+02 -0.371447D+02 -0.568979D+01  0.294985D+01
      5   0.338093D+01  0.403472D+01 -0.514523D+01 -0.612390D+01  0.549585D+01
      6  -0.101856D+01 -0.243336D+01  0.700186D+01  0.659555D+01 -0.214982D+01
               206           207           208           209           210 
      1  -0.417617D-01  0.725705D+00  0.498035D+02  0.589415D+01  0.155296D+02
      2   0.157276D+01  0.247622D+00 -0.269197D+02 -0.357787D+01 -0.924556D+01
      3  -0.153100D+01 -0.973326D+00 -0.228838D+02 -0.231628D+01 -0.628406D+01
      4  -0.507972D+01 -0.370317D+01  0.252043D+01  0.826741D+01  0.953414D+00
      5  -0.390665D+01 -0.352820D+01  0.183359D+02  0.203264D+01  0.140526D+02
      6   0.574389D+01  0.223611D+01 -0.178723D+01  0.603498D+00 -0.144167D+01
               211           212           213           214           215 
      1   0.143523D+02  0.544574D+01  0.346508D+01  0.288413D+02  0.227403D+01
      2  -0.825514D+01 -0.123540D+01 -0.193726D+01 -0.167322D+02 -0.139119D+01
      3  -0.609715D+01 -0.421033D+01 -0.152781D+01 -0.121092D+02 -0.882841D+00
      4   0.969232D+01  0.217245D+01  0.292660D+01  0.774548D+00  0.566786D+01
      5   0.527155D+01  0.285362D+01  0.581362D+01  0.192937D+02  0.323093D+01
      6   0.102527D+01  0.145145D+01  0.161296D+01 -0.116100D+01  0.181771D+01
               216           217           218           219           220 
      1   0.116327D+02 -0.489936D+01 -0.407273D+01  0.110511D+02 -0.964683D+00
      2  -0.102551D+02 -0.427793D+01  0.133920D+01  0.398376D+01 -0.501982D+00
      3  -0.137752D+01  0.917729D+01  0.273352D+01 -0.150349D+02  0.146666D+01
      4   0.241443D+01  0.917305D+01  0.228258D+01 -0.491859D+01  0.234836D+01
      5   0.150576D+02 -0.155622D+02 -0.285137D+00  0.986659D+01  0.333339D+00
      6  -0.114146D+01 -0.342247D+01 -0.704444D+01  0.867774D+01 -0.315748D+01
               221           222           223           224           225 
      1  -0.231752D+01  0.639307D+00  0.664924D+01  0.138358D+01 -0.868976D+01
      2   0.327829D+01 -0.211799D+01  0.201281D+01 -0.743465D+00 -0.750475D+01
      3  -0.960774D+00  0.147868D+01 -0.866205D+01 -0.640111D+00  0.161945D+02
      4  -0.720010D-01 -0.983632D+00 -0.450397D+01 -0.138782D+01  0.351994D+01
      5  -0.207597D+01  0.236598D+01  0.103889D+02  0.136404D+01 -0.569768D+01
      6  -0.225953D+01  0.254402D+01  0.381760D+01  0.364114D+01 -0.542218D+01
               226           227           228           229           230 
      1   0.821354D+01  0.183571D+01  0.942711D+00  0.298768D+01 -0.470844D+00
      2  -0.163505D+02 -0.323989D+01 -0.171097D+02 -0.627609D+01 -0.252335D+00
      3   0.813691D+01  0.140418D+01  0.161670D+02  0.328841D+01  0.723180D+00
      4  -0.390646D+01  0.422934D+01 -0.434056D+01  0.232629D+01  0.349101D+00
      5   0.223781D+02  0.701636D+00  0.245610D+02  0.718954D+01  0.446518D+01
      6  -0.208767D+01  0.566361D+01 -0.368130D+01  0.355161D+01  0.164818D+01
               231           232           233           234           235 
      1  -0.158624D+01  0.172643D+01  0.196937D+00 -0.721980D+01  0.532048D-01
      2  -0.785053D+01 -0.137622D+02 -0.238186D+01 -0.232155D+02  0.171353D+01
      3   0.943678D+01  0.120357D+02  0.218493D+01  0.304353D+02 -0.176673D+01
      4   0.198210D+01 -0.393907D+01  0.227728D+01 -0.279329D+01 -0.471813D+01
      5   0.825868D+01  0.200653D+02  0.131392D+01  0.255308D+02  0.245596D+01
      6   0.377437D+01 -0.220621D+01  0.531616D+01 -0.466604D+01 -0.312693D+01
               236           237           238           239           240 
      1  -0.519010D+00 -0.185981D+00 -0.563832D+00 -0.177258D+02  0.537915D+01
      2  -0.436669D+01 -0.147576D+01 -0.506170D+01  0.378788D+02 -0.168991D+01
      3   0.488570D+01  0.166174D+01  0.562553D+01 -0.201530D+02 -0.368925D+01
      4   0.887888D+01 -0.172039D+01  0.102450D+02 -0.190150D+02  0.308298D+01
      5  -0.321950D+01  0.474440D+01 -0.455600D+01  0.561047D+01 -0.329552D+01
      6   0.437402D+01 -0.143661D+01  0.527040D+01 -0.255736D+02  0.107957D+02
               241           242           243 
      1  -0.515791D+00  0.324415D+00 -0.108990D+01
      2  -0.170270D+01  0.378655D+01  0.144420D+01
      3   0.221849D+01 -0.411096D+01 -0.354297D+00
      4   0.969169D+00 -0.190935D+01 -0.121120D+01
      5   0.255583D+01 -0.512315D+00  0.889630D+00
      6  -0.406905D+00  0.377272D+01 -0.106228D+00

 ----------------------------------------------------------------------

 Electric dipole moment (input orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.124878D+01      0.317408D+01      0.105876D+02
   x          0.119406D+01      0.303501D+01      0.101237D+02
   y          0.361083D+00      0.917782D+00      0.306139D+01
   z         -0.572722D-01     -0.145571D+00     -0.485574D+00

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.111083D+03      0.164608D+02      0.183152D+02
   aniso      0.677782D+01      0.100437D+01      0.111751D+01
   xx         0.114673D+03      0.169928D+02      0.189071D+02
   yx         0.741876D+00      0.109935D+00      0.122319D+00
   yy         0.111152D+03      0.164711D+02      0.183266D+02
   zx        -0.758278D-01     -0.112365D-01     -0.125023D-01
   zy         0.127064D+01      0.188290D+00      0.209500D+00
   zz         0.107424D+03      0.159186D+02      0.177118D+02

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  532.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.117084D+03      0.173501D+02      0.193046D+02
   aniso      0.804647D+01      0.119236D+01      0.132668D+01
   xx         0.121488D+03      0.180027D+02      0.200307D+02
   yx         0.100203D+01      0.148485D+00      0.165212D+00
   yy         0.116779D+03      0.173049D+02      0.192543D+02
   zx        -0.265460D+00     -0.393371D-01     -0.437684D-01
   zy         0.153747D+01      0.227830D+00      0.253495D+00
   zz         0.112986D+03      0.167428D+02      0.186288D+02

 ----------------------------------------------------------------------

 Dipole orientation:
     6         -0.55440022         -1.17173471          1.46637180
     6          1.24713593         -0.40281855         -0.74703837
     6          2.61574463          1.95369828          0.37119695
     6          0.61118167          3.20421283          2.11301033
     6         -1.72790882          1.51709188          1.71388342
     6         -0.64851552          0.75767177         -2.59136653
     6         -2.67770388          2.04378602         -0.97888926
     6          2.96269757         -2.37144722         -1.89400782
     8         -0.55861599          0.69570881         -4.86420062
     6          0.81723188         -2.06481574          3.84584418
     6         -2.45868432         -3.22133534          0.72414468
     1          4.27649071          1.34110061          1.42471294
     1          3.28137911          3.20941930         -1.12036676
     1          0.22713334          5.15972960          1.59196226
     1          1.21840752          3.21039407          4.07944558
     1         -4.51226610          1.19815270         -1.38517635
     1         -2.81080301          4.04784575         -1.44331081
     1         -3.16957693          1.69960168          3.17277441
     1          4.00883928         -1.57506098         -3.48141387
     1          1.88647425         -3.97428452         -2.61650711
     1          4.32140922         -3.06823164         -0.50746853
     1          2.27154457         -0.76486114          4.49357797
     1          1.71470381         -3.89260491          3.51756908
     1         -0.53462285         -2.30896400          5.38737421
     1         -3.40765854         -2.85339603         -1.06519045
     1         -3.90895316         -3.41456202          2.18009863
     1         -1.51424252         -5.04581279          0.54663261

 Electric dipole moment (dipole orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.124878D+01      0.317408D+01      0.105876D+02
   x          0.000000D+00      0.000000D+00      0.000000D+00
   y          0.000000D+00      0.000000D+00      0.000000D+00
   z          0.124878D+01      0.317408D+01      0.105876D+02

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.111083D+03      0.164608D+02      0.183152D+02
   aniso      0.677782D+01      0.100437D+01      0.111751D+01
   xx         0.108442D+03      0.160694D+02      0.178797D+02
   yx        -0.200503D+01     -0.297115D+00     -0.330585D+00
   yy         0.110061D+03      0.163093D+02      0.181466D+02
   zx        -0.484440D+00     -0.717866D-01     -0.798734D-01
   zy        -0.579415D+00     -0.858605D-01     -0.955326D-01
   zz         0.114747D+03      0.170037D+02      0.189192D+02

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  532.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.117084D+03      0.173501D+02      0.193046D+02
   aniso      0.804647D+01      0.119236D+01      0.132668D+01
   xx         0.114168D+03      0.169179D+02      0.188238D+02
   yx        -0.226628D+01     -0.335829D+00     -0.373660D+00
   yy         0.115472D+03      0.171112D+02      0.190387D+02
   zx        -0.405263D+00     -0.600538D-01     -0.668189D-01
   zy        -0.687902D+00     -0.101937D+00     -0.113420D+00
   zz         0.121613D+03      0.180212D+02      0.200513D+02

 ----------------------------------------------------------------------

 Test job not archived.
 1\1\GINC-CPN-K11-30-02\Freq\RLC-PBEPBE\Gen\C10H16O1\PIERPA\16-Jul-2021
 \0\\#P SP LC-PBEPBE/Gen Integral=UltraFineGrid SCF=(NoSymm,MaxCyc=120,
 Tight) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq IOp(1/33=1,3/107=02
 93000000,3/108=0293000000,3/119=1000000000,3/120=1000000000,3/130=-1,3
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 Just remember, when you're over the hill, you begin to pick up speed.
 -- Charles Schulz
 Job cpu time:       0 days 22 hours 19 minutes 43.9 seconds.
 Elapsed time:       0 days  2 hours 48 minutes 51.9 seconds.
 File lengths (MBytes):  RWF=    454 Int=      0 D2E=      0 Chk=     15 Scr=      2
 Normal termination of Gaussian 16 at Fri Jul 16 22:02:58 2021.
